A0A096N290_PAPAN Loading...

Leiomodin-1

Required for proper contractility of visceral smooth muscle cells. Mediates nucleation of actin filaments.

AlphaFold DB (I0FQL5), UniProt , Accession A0A096N290, Species PAPAN (Papio anubis, Olive baboon), Gene LMOD1, Length 600 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	37.8	Very low	246 Å²	246	183.6 Å²	183.6	100%	1.212	87%	0.868	S	S	*	*				0	164.1	0	-66.6	177.2	179.3	0	0	108.9
2	S	37.9	Very low	37.9	Very low	105 Å²	105	174 Å²	174	73%	0.734	84%	0.835	S	S	*	*			trans	25.6	105.2	171.3	-133.8	0	0	0	0	118.3
3	R	37.1	Very low	39	Very low	243 Å²	243	175.6 Å²	175.6	92%	0.917	84%	0.841	S	S	*	*				50.6	75.2	79.8	-64.9	-172.9	175.5	179.5	-0.5	114.4
4	V	35.8	Very low	39.8	Very low	150 Å²	150	168.6 Å²	168.6	91%	0.909	81%	0.811	S	S	*	*			trans	-85.9	121.8	149	177.7	0	0	0	0	107.2
5	A	37.6	Very low	40.9	Very low	79 Å²	79	164.2 Å²	164.2	65%	0.653	80%	0.801	S	S	*	*			trans	-97.5	135.8	-169.9	0	0	0	0	0	113.1	Y7	A5-Y7 PolarHBondContact O-N 3.4Å
6	K	46.1	Very low	42.1	Very low	199 Å²	199	161.4 Å²	161.4	87%	0.865	79%	0.791	S	S	*	*			trans	0.7	103.4	156.7	-60.1	-179.7	176.6	-173.5	0	116.8
7	Y	34.5	Very low	43.4	Very low	224 Å²	224	156.5 Å²	156.5	88%	0.878	77%	0.768	S	S	*	*			trans	-135.9	35.7	149.9	-90.3	-71.6	0	0	0	112.6	A5 R9	A5-Y7 PolarHBondContact O-N 3.4Å; Y7-R9 VanDerWaalsContact C-N 3.35Å; Y7-R9 PolarHBondContact O-N 3.28Å; Y7-R9 VanDerWaalsContact O-N 3.09Å
8	R	37.6	Very low	44.5	Very low	237 Å²	237	153.7 Å²	153.7	89%	0.894	76%	0.757	S	S	*	*			trans	-71.4	96.9	156	-170.5	177.1	-166.2	166.8	4.1	106.1	Q10	R8-Q10 PolarHBondContact O-N 3.14Å
9	R	35.4	Very low	45.8	Very low	225 Å²	225	149 Å²	149	85%	0.849	74%	0.741	S	S	*	*			trans	-56.2	114	166.5	-85.6	-175	175.2	169.4	-3	106.7	Y7 V11	Y7-R9 VanDerWaalsContact C-N 3.35Å; Y7-R9 PolarHBondContact O-N 3.28Å; Y7-R9 VanDerWaalsContact O-N 3.09Å; R9-V11 PolarHBondContact O-N 3.32Å
10	Q	37.1	Very low	46.7	Very low	182 Å²	182	147 Å²	147	85%	0.85	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-64.1	118.4	148.1	-68.7	167.3	-86.2	0	0	104	R8 S12	R8-Q10 PolarHBondContact O-N 3.14Å; Q10-S12 PolarHBondContact O-N 3.3Å
11	V	41.9	Very low	47.5	Very low	130 Å²	130	143.7 Å²	143.7	79%	0.788	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-63.9	116.1	161	177	0	0	0	0	103.8	R9	R9-V11 PolarHBondContact O-N 3.32Å
12	S	39.3	Very low	49.2	Very low	68 Å²	68	140.1 Å²	140.1	48%	0.476	70%	0.697	S	S	.	*	P	Polyproline II helix	trans	-66.5	144.5	172.5	32.3	0	0	0	0	108.6	Q10 D14	Q10-S12 PolarHBondContact O-N 3.3Å; S12-D14 WeakPolarHBondContact CB-OD1 3.44Å; S12-D14 PolarHBondContact O-N 3.18Å; S12-D14 PolarHBondContact OG-OD1 3.42Å
13	E	52.1	Low	50.9	Low	195 Å²	195	140.1 Å²	140.1	91%	0.911	69%	0.693	S	S	*	*			trans	-69.3	76.6	164.7	-64.9	160.7	162.5	0	0	106.6	P15	E13-P15 VanDerWaalsContact O-CD 3.24Å; E13-P15 WeakPolarHBondContact O-CD 3.31Å
14	D	50.5	Low	52.4	Low	78 Å²	78	131.3 Å²	131.3	42%	0.417	66%	0.664	S	S	.	*			trans	-74.1	106.7	177.9	-70.8	-9.9	0	0	0	107.2	S12 D16 I17	S12-D14 WeakPolarHBondContact CB-OD1 3.44Å; S12-D14 PolarHBondContact O-N 3.18Å; S12-D14 PolarHBondContact OG-OD1 3.42Å; D14-D16 PolarHBondContact O-N 2.83Å; D14-I17 HydrophobicContact CB-CD1 3.85Å; D14-I17 HydrophobicContact CB-CG1 3.97Å; D14-I17 WeakPolarHBondContact O-CB 3.31Å; D14-I17 PolarHBondContact O-N 3.03Å
15	P	56.4	Low	54.4	Low	102 Å²	102	126.2 Å²	126.2	66%	0.662	63%	0.634	S	S	*	*	H	α-helix	trans	-68.2	-10.2	-168.9	29.7	-37.1	0	0	0	113.6	E13 I17	E13-P15 VanDerWaalsContact O-CD 3.24Å; E13-P15 WeakPolarHBondContact O-CD 3.31Å; P15-I17 VanDerWaalsContact C-N 3.34Å
16	D	59.5	Low	55.9	Low	119 Å²	119	127.7 Å²	127.7	64%	0.636	64%	0.637	S	S	*	*	H	α-helix	trans	-75.2	-21	172.3	-62.8	-38.7	0	0	0	112.4	D14 L20	D14-D16 PolarHBondContact O-N 2.83Å; D16-L20 WeakPolarHBondContact O-CB 3.46Å; D16-L20 WeakPolarHBondContact O-CD1 3.36Å; D16-L20 VanDerWaalsContact O-CG 3.23Å; D16-L20 WeakPolarHBondContact O-CG 3.22Å; D16-L20 PolarHBondContact O-N 3.32Å
17	I	65.1	Low	57.2	Low	79 Å²	79	126 Å²	126	41%	0.405	63%	0.632	S	S	.	*	H	α-helix	trans	-70.2	-48.7	-179.7	-64.3	177.6	0	0	0	110.8	D14 P15 S19 L20 L21	D14-I17 HydrophobicContact CB-CD1 3.85Å; D14-I17 HydrophobicContact CB-CG1 3.97Å; D14-I17 WeakPolarHBondContact O-CB 3.31Å; D14-I17 PolarHBondContact O-N 3.03Å; P15-I17 VanDerWaalsContact C-N 3.34Å; I17-S19 VanDerWaalsContact C-N 3.31Å; I17-S19 PolarHBondContact O-N 3Å; I17-L20 WeakPolarHBondContact O-CB 3.24Å; I17-L20 PolarHBondContact O-N 2.93Å; I17-L20 VanDerWaalsContact O-N 3.11Å; I17-L21 HydrophobicContact CG2-CD1 4.15Å; I17-L21 WeakPolarHBondContact O-CG 3.49Å; I17-L21 PolarHBondContact O-N 3.17Å
18	D	62	Low	59.2	Low	106 Å²	106	119.6 Å²	119.6	57%	0.567	61%	0.611	S	S	*	*	H	α-helix	trans	-64.9	-39.1	179.1	-60.4	-36.5	0	0	0	110.6	L20 L21 E22	D18-L20 VanDerWaalsContact C-N 3.32Å; D18-L20 PolarHBondContact O-N 2.93Å; D18-L21 PolarHBondContact O-N 2.89Å; D18-E22 WeakPolarHBondContact O-CG 3.36Å; D18-E22 PolarHBondContact O-N 3Å
19	S	69.1	Low	61	Low	64 Å²	64	112.5 Å²	112.5	45%	0.448	59%	0.589	S	S	.	*	H	α-helix	trans	-62.6	-34	172.1	-174.9	0	0	0	0	113.1	I17 T23	I17-S19 VanDerWaalsContact C-N 3.31Å; I17-S19 PolarHBondContact O-N 3Å; S19-T23 WeakPolarHBondContact O-CG2 3.49Å; S19-T23 PolarHBondContact O-N 2.96Å; S19-T23 PolarHBondContact O-OG1 2.95Å
20	L	64	Low	62.5	Low	108 Å²	108	107.1 Å²	107.1	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-69.4	-44.2	172.5	-81.2	162.7	0	0	0	111.4	D16 I17 D18 E22 T23 L24	D16-L20 WeakPolarHBondContact O-CB 3.46Å; D16-L20 WeakPolarHBondContact O-CD1 3.36Å; D16-L20 VanDerWaalsContact O-CG 3.23Å; D16-L20 WeakPolarHBondContact O-CG 3.22Å; D16-L20 PolarHBondContact O-N 3.32Å; I17-L20 WeakPolarHBondContact O-CB 3.24Å; I17-L20 PolarHBondContact O-N 2.93Å; I17-L20 VanDerWaalsContact O-N 3.11Å; D18-L20 VanDerWaalsContact C-N 3.32Å; D18-L20 PolarHBondContact O-N 2.93Å; L20-E22 VanDerWaalsContact C-N 3.34Å; L20-E22 PolarHBondContact O-N 3.39Å; L20-T23 PolarHBondContact O-N 2.94Å; L20-T23 PolarHBondContact O-OG1 3.32Å; L20-L24 PolarHBondContact O-N 2.73Å
21	L	64.5	Low	64.2	Low	78 Å²	78	104.9 Å²	104.9	41%	0.408	56%	0.563	S	S	.	*	H	α-helix	trans	-61.5	-39.6	175.8	-67.9	169.4	0	0	0	112	I17 D18 T23 L24 M29	I17-L21 HydrophobicContact CG2-CD1 4.15Å; I17-L21 WeakPolarHBondContact O-CG 3.49Å; I17-L21 PolarHBondContact O-N 3.17Å; D18-L21 PolarHBondContact O-N 2.89Å; L21-T23 PolarHBondContact O-N 3.16Å; L21-L24 HydrophobicContact CD2-CD1 4.31Å; L21-L24 PolarHBondContact O-N 2.9Å; L21-M29 HydrophobicContact CD2-SD 3.9Å
22	E	70.5	Confident	65.4	Low	171 Å²	171	102.6 Å²	102.6	80%	0.799	55%	0.546	S	S	*	.	H	α-helix	trans	-65.2	-20.4	173.2	-74.8	-173.5	163	0	0	113.8	D18 L20	D18-E22 WeakPolarHBondContact O-CG 3.36Å; D18-E22 PolarHBondContact O-N 3Å; L20-E22 VanDerWaalsContact C-N 3.34Å; L20-E22 PolarHBondContact O-N 3.39Å
23	T	72.4	Confident	66.8	Low	106 Å²	106	105.8 Å²	105.8	65%	0.65	55%	0.553	S	S	*	*	H	α-helix	trans	-95.2	-11.6	177.2	60.2	0	0	0	0	115	S19 L20 L21	S19-T23 WeakPolarHBondContact O-CG2 3.49Å; S19-T23 PolarHBondContact O-N 2.96Å; S19-T23 PolarHBondContact O-OG1 2.95Å; L20-T23 PolarHBondContact O-N 2.94Å; L20-T23 PolarHBondContact O-OG1 3.32Å; L21-T23 PolarHBondContact O-N 3.16Å
24	L	68.3	Low	67.4	Low	58 Å²	58	102 Å²	102	30%	0.304	53%	0.534	S	S	.	.	S	Bend	trans	-79.8	139.2	178.1	-76.4	161.6	0	0	0	110.8	L20 L21 E28 M29 L32	L20-L24 PolarHBondContact O-N 2.73Å; L21-L24 HydrophobicContact CD2-CD1 4.31Å; L21-L24 PolarHBondContact O-N 2.9Å; L24-E28 HydrophobicContact CD2-CB 3.86Å; L24-E28 HydrophobicContact CD2-CG 4.49Å; L24-M29 HydrophobicContact CB-CG 4.37Å; L24-L32 HydrophobicContact CD1-CD1 3.71Å
25	S	78.4	Confident	68.2	Low	42 Å²	42	104.8 Å²	104.8	29%	0.294	54%	0.544	S	S	.	.			trans	-73	156.5	173.7	70.3	0	0	0	0	111.2	E27 E28 M29	S25-E27 PolarHBondContact O-N 3Å; S25-E28 WeakPolarHBondContact CB-OE2 3.42Å; S25-E28 PolarHBondContact N-OE2 3.46Å; S25-E28 PolarHBondContact O-N 3.47Å; S25-E28 VanDerWaalsContact OG-CD 3.31Å; S25-E28 WeakPolarHBondContact OG-CG 3.47Å; S25-E28 PolarHBondContact OG-N 3.45Å; S25-E28 PolarHBondContact OG-OE2 3.46Å; S25-M29 PolarHBondContact O-N 2.97Å
26	P	70.1	Confident	68.3	Low	110 Å²	110	106.3 Å²	106.3	71%	0.714	55%	0.546	S	S	*	.	H	α-helix	trans	-61.5	-24.3	177.6	23.3	-34	0	0	0	113.6	E30	P26-E30 PolarHBondContact O-N 3.42Å; P26-E30 VanDerWaalsContact O-N 3.12Å
27	E	73.4	Confident	68	Low	163 Å²	163	107.4 Å²	107.4	76%	0.762	55%	0.552	S	S	*	*	H	α-helix	trans	-70.4	-39.5	173.1	-63.5	-175.5	166.7	0	0	111.3	S25 E30 E31	S25-E27 PolarHBondContact O-N 3Å; E27-E30 PolarHBondContact O-N 3.23Å; E27-E31 PolarHBondContact O-N 2.87Å; E27-E31 VanDerWaalsContact O-N 3.09Å
28	E	75.9	Confident	67.6	Low	90 Å²	90	106.9 Å²	106.9	42%	0.421	55%	0.552	S	S	.	*	H	α-helix	trans	-72.4	-31.9	176.2	-67.1	160.4	127.6	0	0	112.2	L24 S25 E31 L32	L24-E28 HydrophobicContact CD2-CB 3.86Å; L24-E28 HydrophobicContact CD2-CG 4.49Å; S25-E28 WeakPolarHBondContact CB-OE2 3.42Å; S25-E28 PolarHBondContact N-OE2 3.46Å; S25-E28 PolarHBondContact O-N 3.47Å; S25-E28 VanDerWaalsContact OG-CD 3.31Å; S25-E28 WeakPolarHBondContact OG-CG 3.47Å; S25-E28 PolarHBondContact OG-N 3.45Å; S25-E28 PolarHBondContact OG-OE2 3.46Å; E28-E31 PolarHBondContact O-N 2.65Å; E28-L32 WeakPolarHBondContact O-CB 3.39Å; E28-L32 WeakPolarHBondContact O-CG 3.24Å; E28-L32 PolarHBondContact O-N 2.94Å
29	M	74.3	Confident	67.3	Low	88 Å²	88	106.8 Å²	106.8	43%	0.433	56%	0.555	S	S	.	*	H	α-helix	trans	-63.5	-43.3	169.8	-77	-74.7	-69.5	0	0	112	L21 L24 S25 E31 L32 E33	L21-M29 HydrophobicContact CD2-SD 3.9Å; L24-M29 HydrophobicContact CB-CG 4.37Å; S25-M29 PolarHBondContact O-N 2.97Å; M29-E31 VanDerWaalsContact C-N 3.29Å; M29-E31 PolarHBondContact O-N 3.23Å; M29-L32 PolarHBondContact O-N 2.91Å; M29-E33 PolarHBondContact O-N 3.3Å
30	E	68.5	Low	66.7	Low	112 Å²	112	108.4 Å²	108.4	52%	0.523	56%	0.559	S	S	.	*	H	α-helix	trans	-69	-26.9	176.5	-157.7	-160.2	132.2	0	0	112.4	P26 E27 K34	P26-E30 PolarHBondContact O-N 3.42Å; P26-E30 VanDerWaalsContact O-N 3.12Å; E27-E30 PolarHBondContact O-N 3.23Å; E30-K34 WeakPolarHBondContact O-CG 3.45Å; E30-K34 PolarHBondContact O-N 2.94Å; E30-K34 PolarHBondContact O-NZ 2.93Å; E30-K34 IonicContact OE1-NZ 3.61Å; E30-K34 PolarHBondContact OE1-NZ 3.43Å
31	E	72.1	Confident	66.4	Low	135 Å²	135	108 Å²	108	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-74.6	-40.2	172.4	-169	160.8	-139.1	0	0	111.7	E27 E28 M29 K34 E35	E27-E31 PolarHBondContact O-N 2.87Å; E27-E31 VanDerWaalsContact O-N 3.09Å; E28-E31 PolarHBondContact O-N 2.65Å; M29-E31 VanDerWaalsContact C-N 3.29Å; M29-E31 PolarHBondContact O-N 3.23Å; E31-K34 WeakPolarHBondContact O-CB 2.99Å; E31-K34 PolarHBondContact O-N 3.34Å; E31-E35 PolarHBondContact O-N 2.79Å
32	L	67.6	Low	66	Low	82 Å²	82	108.4 Å²	108.4	43%	0.429	57%	0.565	S	S	.	*	H	α-helix	trans	-64	-40.2	172.3	-80.8	164	0	0	0	112.9	L24 E28 M29 E35 L36	L24-L32 HydrophobicContact CD1-CD1 3.71Å; E28-L32 WeakPolarHBondContact O-CB 3.39Å; E28-L32 WeakPolarHBondContact O-CG 3.24Å; E28-L32 PolarHBondContact O-N 2.94Å; M29-L32 PolarHBondContact O-N 2.91Å; L32-E35 PolarHBondContact O-N 3.11Å; L32-L36 PolarHBondContact O-N 3.34Å
33	E	67.4	Low	65.5	Low	135 Å²	135	103.1 Å²	103.1	63%	0.631	56%	0.556	S	S	*	*	H	α-helix	trans	-64.3	-40.8	174.8	-167.9	168.1	-147.5	0	0	110.9	M29 E35 L36 D37	M29-E33 PolarHBondContact O-N 3.3Å; E33-E35 PolarHBondContact O-N 2.92Å; E33-L36 WeakPolarHBondContact O-CB 3.27Å; E33-L36 PolarHBondContact O-N 3.21Å; E33-D37 PolarHBondContact O-N 3.23Å
34	K	65.7	Low	65.1	Low	116 Å²	116	102.5 Å²	102.5	50%	0.504	56%	0.556	S	S	.	*	H	α-helix	trans	-62.6	-37.9	170.4	-81.4	-172.9	-162	70.2	0	113.7	E30 E31 L36 V38	E30-K34 WeakPolarHBondContact O-CG 3.45Å; E30-K34 PolarHBondContact O-N 2.94Å; E30-K34 PolarHBondContact O-NZ 2.93Å; E30-K34 IonicContact OE1-NZ 3.61Å; E30-K34 PolarHBondContact OE1-NZ 3.43Å; E31-K34 WeakPolarHBondContact O-CB 2.99Å; E31-K34 PolarHBondContact O-N 3.34Å; K34-L36 VanDerWaalsContact C-N 3.32Å; K34-V38 VanDerWaalsContact O-CG2 3.31Å; K34-V38 WeakPolarHBondContact O-CG2 3.17Å; K34-V38 PolarHBondContact O-N 3.05Å
35	E	66.2	Low	64.6	Low	137 Å²	137	102.3 Å²	102.3	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-66.8	-35.3	174	-75.7	-146	128.6	0	0	111.5	E31 L32 E33 V38 V39	E31-E35 PolarHBondContact O-N 2.79Å; L32-E35 PolarHBondContact O-N 3.11Å; E33-E35 PolarHBondContact O-N 2.92Å; E35-V38 WeakPolarHBondContact O-CB 3.24Å; E35-V38 PolarHBondContact O-N 2.92Å; E35-V39 WeakPolarHBondContact O-CG2 3.41Å
36	L	59	Low	63.9	Low	133 Å²	133	104.5 Å²	104.5	70%	0.696	57%	0.571	S	S	*	*	H	α-helix	trans	-66	-43.9	177.6	-142.5	76.6	0	0	0	112.1	L32 E33 K34 V38 V39	L32-L36 PolarHBondContact O-N 3.34Å; E33-L36 WeakPolarHBondContact O-CB 3.27Å; E33-L36 PolarHBondContact O-N 3.21Å; K34-L36 VanDerWaalsContact C-N 3.32Å; L36-V38 PolarHBondContact O-N 2.59Å; L36-V38 VanDerWaalsContact O-N 3.12Å; L36-V39 WeakPolarHBondContact O-CB 3.46Å; L36-V39 WeakPolarHBondContact O-CG2 3.36Å; L36-V39 PolarHBondContact O-N 2.84Å; L36-V39 VanDerWaalsContact O-N 3.07Å
37	D	54.3	Low	63.3	Low	143 Å²	143	105.2 Å²	105.2	77%	0.765	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-13.6	174.5	-95.3	-1.5	0	0	0	113.8	E33	E33-D37 PolarHBondContact O-N 3.23Å
38	V	56	Low	62.3	Low	68 Å²	68	101 Å²	101	41%	0.412	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-15.9	175.7	167.6	0	0	0	0	112.8	K34 E35 L36 R52	K34-V38 VanDerWaalsContact O-CG2 3.31Å; K34-V38 WeakPolarHBondContact O-CG2 3.17Å; K34-V38 PolarHBondContact O-N 3.05Å; E35-V38 WeakPolarHBondContact O-CB 3.24Å; E35-V38 PolarHBondContact O-N 2.92Å; L36-V38 PolarHBondContact O-N 2.59Å; L36-V38 VanDerWaalsContact O-N 3.12Å; V38-R52 PolarHBondContact O-NH2 3.35Å
39	V	55.9	Low	61.5	Low	103 Å²	103	103.1 Å²	103.1	62%	0.624	59%	0.587	S	S	*	*	S	Bend	trans	-72.5	-35.3	-163.5	175.9	0	0	0	0	115.5	E35 L36	E35-V39 WeakPolarHBondContact O-CG2 3.41Å; L36-V39 WeakPolarHBondContact O-CB 3.46Å; L36-V39 WeakPolarHBondContact O-CG2 3.36Å; L36-V39 PolarHBondContact O-N 2.84Å; L36-V39 VanDerWaalsContact O-N 3.07Å
40	D	55.1	Low	61.1	Low	98 Å²	98	103 Å²	103	52%	0.524	58%	0.582	S	S	.	*			trans	-139.6	91.1	-179.1	-149.8	-12	0	0	0	116	D42 G43 R50	D40-D42 PolarHBondContact OD1-N 3.04Å; D40-G43 PolarHBondContact OD1-N 3.36Å; D40-R50 IonicContact OD1-CZ 3.61Å; D40-R50 IonicContact OD1-NH1 3.59Å; D40-R50 PolarHBondContact OD1-NH1 3.13Å; D40-R50 IonicContact OD1-NH2 3.5Å; D40-R50 IonicContact OD2-NH1 3.61Å
41	P	58.4	Low	60.4	Low	99 Å²	99	105.9 Å²	105.9	64%	0.643	60%	0.595	S	S	*	*	S	Bend	trans	-74.9	-23.5	169.5	-17.7	33.1	0	0	0	114.5
42	D	56.2	Low	59.4	Low	87 Å²	87	106.2 Å²	106.2	47%	0.465	59%	0.591	S	S	.	*			trans	-168.3	113.6	-178.6	-173.1	-27.4	0	0	0	110.2	D40 S44 V45 R50	D40-D42 PolarHBondContact OD1-N 3.04Å; D42-S44 PolarHBondContact O-N 2.95Å; D42-S44 VanDerWaalsContact O-N 3.11Å; D42-S44 WeakPolarHBondContact OD1-CB 3.21Å; D42-S44 PolarHBondContact OD1-N 2.62Å; D42-S44 PolarHBondContact OD1-OG 3.27Å; D42-S44 PolarHBondContact OD2-OG 3.35Å; D42-V45 HydrophobicContact CB-CG2 4.47Å; D42-R50 VanDerWaalsContact O-CZ 3.3Å; D42-R50 PolarHBondContact O-NH1 3.14Å; D42-R50 PolarHBondContact O-NH2 3.08Å
43	G	60.9	Low	58.9	Low	60 Å²	60	109.5 Å²	109.5	62%	0.619	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-14.3	179.6	0	0	0	0	0	115.6	D40 R50	D40-G43 PolarHBondContact OD1-N 3.36Å; G43-R50 VanDerWaalsContact C-NH2 3.27Å; G43-R50 PolarHBondContact O-NH2 2.78Å
44	S	63.3	Low	58.1	Low	93 Å²	93	112 Å²	112	65%	0.65	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-22.5	-175.3	70.7	0	0	0	0	115	D42	D42-S44 PolarHBondContact O-N 2.95Å; D42-S44 VanDerWaalsContact O-N 3.11Å; D42-S44 WeakPolarHBondContact OD1-CB 3.21Å; D42-S44 PolarHBondContact OD1-N 2.62Å; D42-S44 PolarHBondContact OD1-OG 3.27Å; D42-S44 PolarHBondContact OD2-OG 3.35Å
45	V	57.5	Low	57.5	Low	55 Å²	55	110.9 Å²	110.9	33%	0.333	62%	0.624	S	S	.	*	S	Bend	trans	-81.6	132.7	-171.4	-176.7	0	0	0	0	111.8	D42 L49 R50	D42-V45 HydrophobicContact CB-CG2 4.47Å; V45-L49 HydrophobicContact CG1-CB 4.08Å; V45-R50 HydrophobicContact CB-CG 4.37Å; V45-R50 HydrophobicContact CG1-CG 4.17Å; V45-R50 PolarHBondContact O-NE 2.96Å; V45-R50 PolarHBondContact O-NH2 2.85Å
46	P	63.2	Low	56.9	Low	88 Å²	88	114.1 Å²	114.1	57%	0.571	64%	0.639	S	S	*	*			trans	-60	136.6	174.9	-24.8	34.6	0	0	0	113	G48 L49	P46-G48 VanDerWaalsContact C-N 3.26Å; P46-G48 PolarHBondContact O-N 3.44Å; P46-G48 VanDerWaalsContact O-N 3.09Å; P46-L49 PolarHBondContact O-N 3.24Å
47	V	58.8	Low	57	Low	124 Å²	124	116 Å²	116	75%	0.752	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-51.1	-40.3	-172.5	178.7	0	0	0	0	113.8	L49 R50	V47-L49 PolarHBondContact O-N 3.35Å; V47-R50 PolarHBondContact O-N 3.48Å; V47-R50 VanDerWaalsContact O-N 3.11Å
48	G	53	Low	57.2	Low	76 Å²	76	117.9 Å²	117.9	78%	0.784	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-66.3	-4.3	178.7	0	0	0	0	0	115.8	P46	P46-G48 VanDerWaalsContact C-N 3.26Å; P46-G48 PolarHBondContact O-N 3.44Å; P46-G48 VanDerWaalsContact O-N 3.09Å
49	L	58.5	Low	57.5	Low	134 Å²	134	120.2 Å²	120.2	70%	0.702	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-114.6	-0.3	175.9	-62.2	174.1	0	0	0	112.9	V45 P46 V47 Q51	V45-L49 HydrophobicContact CG1-CB 4.08Å; P46-L49 PolarHBondContact O-N 3.24Å; V47-L49 PolarHBondContact O-N 3.35Å; L49-Q51 PolarHBondContact O-N 2.99Å
50	R	64.6	Low	57.9	Low	84 Å²	84	122 Å²	122	32%	0.317	68%	0.676	S	S	.	*			trans	-80.9	35.3	-177.2	-64.4	-176.3	175.6	-116.4	-12.3	114.2	D40 D42 G43 V45 V47	D40-R50 IonicContact OD1-CZ 3.61Å; D40-R50 IonicContact OD1-NH1 3.59Å; D40-R50 PolarHBondContact OD1-NH1 3.13Å; D40-R50 IonicContact OD1-NH2 3.5Å; D40-R50 IonicContact OD2-NH1 3.61Å; D42-R50 VanDerWaalsContact O-CZ 3.3Å; D42-R50 PolarHBondContact O-NH1 3.14Å; D42-R50 PolarHBondContact O-NH2 3.08Å; G43-R50 VanDerWaalsContact C-NH2 3.27Å; G43-R50 PolarHBondContact O-NH2 2.78Å; V45-R50 HydrophobicContact CB-CG 4.37Å; V45-R50 HydrophobicContact CG1-CG 4.17Å; V45-R50 PolarHBondContact O-NE 2.96Å; V45-R50 PolarHBondContact O-NH2 2.85Å; V47-R50 PolarHBondContact O-N 3.48Å; V47-R50 VanDerWaalsContact O-N 3.11Å
51	Q	54.3	Low	58.7	Low	174 Å²	174	120.4 Å²	120.4	81%	0.813	68%	0.683	S	S	*	*			trans	-98.4	104.7	-172.1	-156.8	168.1	16.3	0	0	111.5	L49	L49-Q51 PolarHBondContact O-N 2.99Å
52	R	51.2	Low	59.4	Low	141 Å²	141	122.4 Å²	122.4	53%	0.532	69%	0.693	S	S	.	*			trans	-67.9	133.3	172.1	-70.1	-171.8	-174.6	-174.6	6.5	110	V38 Q54	V38-R52 PolarHBondContact O-NH2 3.35Å; R52-Q54 PolarHBondContact O-N 2.6Å
53	N	57.1	Low	60.1	Low	151 Å²	151	125.8 Å²	125.8	81%	0.807	70%	0.701	S	S	*	*			trans	-73	90.4	171.7	-78.2	-44.4	0	0	0	110.6	T55	N53-T55 PolarHBondContact O-N 3.44Å
54	Q	51.1	Low	61	Low	187 Å²	187	127.3 Å²	127.3	87%	0.874	70%	0.695	S	S	*	*			trans	-74.2	68.9	172.8	-68.8	178.2	-18.8	0	0	111.2	R52	R52-Q54 PolarHBondContact O-N 2.6Å
55	T	52.3	Low	61.7	Low	93 Å²	93	130.6 Å²	130.6	57%	0.571	69%	0.693	S	S	*	*			trans	-137.2	120	174.4	70	0	0	0	0	112.2	N53 K57	N53-T55 PolarHBondContact O-N 3.44Å; T55-K57 PolarHBondContact O-N 2.94Å
56	E	53.6	Low	63	Low	205 Å²	205	134.5 Å²	134.5	96%	0.958	71%	0.707	S	S	*	*			trans	-68.8	-6.4	170.5	-58	179.2	156.5	0	0	113.5	Q58	E56-Q58 PolarHBondContact O-N 2.98Å
57	K	61.1	Low	63.8	Low	173 Å²	173	133 Å²	133	75%	0.752	70%	0.702	S	S	*	*	S	Bend	trans	-69.7	121.9	179.6	-65.5	179.4	-178.7	175.3	0	109.8	T55	T55-K57 PolarHBondContact O-N 2.94Å
58	Q	59.1	Low	65	Low	182 Å²	182	130.9 Å²	130.9	85%	0.85	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-57.2	145.5	167.5	-66.3	-172.7	-8.5	0	0	110.5	E56 T60	E56-Q58 PolarHBondContact O-N 2.98Å; Q58-T60 PolarHBondContact O-N 3.39Å
59	S	63.5	Low	66.4	Low	118 Å²	118	130.4 Å²	130.4	83%	0.825	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-58.8	124.5	-175.7	46.7	0	0	0	0	110.9	G61	S59-G61 PolarHBondContact O-N 3.04Å
60	T	63.9	Low	67.8	Low	140 Å²	140	127.9 Å²	127.9	86%	0.859	65%	0.651	S	S	*	*			trans	-80.1	35.7	-170.4	-34.5	0	0	0	0	112.9	Q58	Q58-T60 PolarHBondContact O-N 3.39Å
61	G	70.5	Confident	68.9	Low	65 Å²	65	130 Å²	130	67%	0.67	66%	0.663	S	S	*	*			trans	70.2	-170	-173.9	0	0	0	0	0	114.2	S59	S59-G61 PolarHBondContact O-N 3.04Å
62	V	74.4	Confident	70.3	Confident	141 Å²	141	124.6 Å²	124.6	86%	0.855	64%	0.644	S	S	*	*	S	Bend	trans	-76.5	140.3	172.3	-178.7	0	0	0	0	109.3	N64	V62-N64 PolarHBondContact O-N 3.4Å
63	Y	70.9	Confident	72.1	Confident	158 Å²	158	122.5 Å²	122.5	62%	0.62	64%	0.64	S	S	*	*			trans	-56.8	107.1	-179.8	168.9	-105.7	0	0	0	112.4	R65 M68	Y63-R65 HydrophobicContact CE1-CB 3.89Å; Y63-R65 HydrophobicContact CE1-CG 4.43Å; Y63-R65 PolarHBondContact O-N 3.18Å; Y63-M68 HydrophobicContact CE2-CB 4.5Å; Y63-M68 HydrophobicContact CE2-SD 4.03Å; Y63-M68 WeakPolarHBondContact OH-CE 3.23Å; Y63-M68 PolarHBondContact OH-SD 3.5Å; Y63-M68 VanDerWaalsContact OH-SD 3.36Å
64	N	79.1	Confident	73.5	Confident	92 Å²	92	121.5 Å²	121.5	49%	0.492	63%	0.629	S	S	.	*			trans	-91.1	101.8	174.5	-174.5	-30	0	0	0	110.5	V62 E66 A67 M68	V62-N64 PolarHBondContact O-N 3.4Å; N64-E66 VanDerWaalsContact C-N 3.29Å; N64-E66 PolarHBondContact O-N 3.09Å; N64-E66 WeakPolarHBondContact OD1-CB 3.42Å; N64-E66 PolarHBondContact OD1-N 3.12Å; N64-A67 HydrophobicContact CB-CB 3.96Å; N64-A67 PolarHBondContact O-N 3.33Å; N64-A67 PolarHBondContact OD1-N 3.45Å; N64-M68 PolarHBondContact O-N 2.61Å
65	R	79.1	Confident	75.2	Confident	161 Å²	161	116 Å²	116	61%	0.608	60%	0.603	S	S	*	*	H	α-helix	trans	-59	-35.6	178.6	-175.7	176.9	177.9	-87.8	0.1	113.2	Y63 L69	Y63-R65 HydrophobicContact CE1-CB 3.89Å; Y63-R65 HydrophobicContact CE1-CG 4.43Å; Y63-R65 PolarHBondContact O-N 3.18Å; R65-L69 HydrophobicContact CG-CD1 4.12Å; R65-L69 VanDerWaalsContact O-CG 3.31Å; R65-L69 WeakPolarHBondContact O-CG 3.42Å; R65-L69 PolarHBondContact O-N 2.71Å
66	E	83.9	Confident	76.7	Confident	138 Å²	138	115.4 Å²	115.4	65%	0.645	60%	0.599	S	S	*	*	H	α-helix	trans	-73.2	-38.1	-179.4	-60.4	-175.1	163.4	0	0	111.8	N64 M68 L69 N70	N64-E66 VanDerWaalsContact C-N 3.29Å; N64-E66 PolarHBondContact O-N 3.09Å; N64-E66 WeakPolarHBondContact OD1-CB 3.42Å; N64-E66 PolarHBondContact OD1-N 3.12Å; E66-M68 VanDerWaalsContact C-N 3.32Å; E66-M68 PolarHBondContact O-N 3.09Å; E66-L69 PolarHBondContact O-N 2.72Å; E66-N70 VanDerWaalsContact O-CB 3.32Å; E66-N70 WeakPolarHBondContact O-CB 3.37Å; E66-N70 PolarHBondContact O-N 3.06Å; E66-N70 PolarHBondContact O-ND2 2.93Å
67	A	80.6	Confident	78.1	Confident	55 Å²	55	111 Å²	111	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-62	-41.5	173.9	0	0	0	0	0	111.4	N64 F71	N64-A67 HydrophobicContact CB-CB 3.96Å; N64-A67 PolarHBondContact O-N 3.33Å; N64-A67 PolarHBondContact OD1-N 3.45Å; A67-F71 WeakPolarHBondContact O-CB 3.41Å; A67-F71 PolarHBondContact O-N 2.87Å
68	M	83	Confident	79.2	Confident	80 Å²	80	108.3 Å²	108.3	39%	0.394	57%	0.565	S	S	.	*	H	α-helix	trans	-63.5	-48.3	174.1	-173.7	-160.4	70.9	0	0	112	Y63 N64 E66 N70 F71 C72	Y63-M68 HydrophobicContact CE2-CB 4.5Å; Y63-M68 HydrophobicContact CE2-SD 4.03Å; Y63-M68 WeakPolarHBondContact OH-CE 3.23Å; Y63-M68 PolarHBondContact OH-SD 3.5Å; Y63-M68 VanDerWaalsContact OH-SD 3.36Å; N64-M68 PolarHBondContact O-N 2.61Å; E66-M68 VanDerWaalsContact C-N 3.32Å; E66-M68 PolarHBondContact O-N 3.09Å; M68-N70 PolarHBondContact O-N 3.37Å; M68-F71 WeakPolarHBondContact O-CB 3.14Å; M68-F71 PolarHBondContact O-N 3.22Å; M68-F71 VanDerWaalsContact O-N 3.13Å; M68-C72 PolarHBondContact O-N 3.3Å; M68-C72 PolarHBondContact O-SG 2.9Å; M68-C72 VanDerWaalsContact O-SG 3.38Å
69	L	83.2	Confident	80.2	Confident	67 Å²	67	104.4 Å²	104.4	35%	0.351	55%	0.55	S	S	.	.	H	α-helix	trans	-62.2	-43.1	179.1	-71.5	170.1	0	0	0	111.7	R65 E66 F71 C72 E73	R65-L69 HydrophobicContact CG-CD1 4.12Å; R65-L69 VanDerWaalsContact O-CG 3.31Å; R65-L69 WeakPolarHBondContact O-CG 3.42Å; R65-L69 PolarHBondContact O-N 2.71Å; E66-L69 PolarHBondContact O-N 2.72Å; L69-F71 VanDerWaalsContact C-N 3.28Å; L69-F71 PolarHBondContact O-N 2.86Å; L69-C72 PolarHBondContact O-N 3.39Å; L69-E73 PolarHBondContact O-N 3.13Å
70	N	87	Confident	80.9	Confident	81 Å²	81	103.7 Å²	103.7	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-61.3	-33.8	173.7	-85.8	-80.8	0	0	0	113	E66 M68 K74	E66-N70 VanDerWaalsContact O-CB 3.32Å; E66-N70 WeakPolarHBondContact O-CB 3.37Å; E66-N70 PolarHBondContact O-N 3.06Å; E66-N70 PolarHBondContact O-ND2 2.93Å; M68-N70 PolarHBondContact O-N 3.37Å; N70-K74 WeakPolarHBondContact O-CB 3.46Å; N70-K74 WeakPolarHBondContact O-CD 3.36Å; N70-K74 WeakPolarHBondContact O-CG 3.49Å; N70-K74 PolarHBondContact O-N 3.43Å; N70-K74 VanDerWaalsContact O-N 3.1Å
71	F	87.9	Confident	81.4	Confident	127 Å²	127	104 Å²	104	56%	0.557	53%	0.526	S	S	*	.	H	α-helix	trans	-68.2	-50.1	173.1	176.4	-96.9	0	0	0	111.2	A67 M68 L69 E73 K74 E75	A67-F71 WeakPolarHBondContact O-CB 3.41Å; A67-F71 PolarHBondContact O-N 2.87Å; M68-F71 WeakPolarHBondContact O-CB 3.14Å; M68-F71 PolarHBondContact O-N 3.22Å; M68-F71 VanDerWaalsContact O-N 3.13Å; L69-F71 VanDerWaalsContact C-N 3.28Å; L69-F71 PolarHBondContact O-N 2.86Å; F71-E73 VanDerWaalsContact C-N 3.31Å; F71-E73 PolarHBondContact O-N 3.43Å; F71-K74 PolarHBondContact O-N 2.78Å; F71-K74 VanDerWaalsContact O-N 3.09Å; F71-E75 HydrophobicContact CD1-CG 4.37Å; F71-E75 HydrophobicContact CD2-CG 4.36Å; F71-E75 HydrophobicContact CE1-CG 3.89Å; F71-E75 HydrophobicContact CE2-CG 3.87Å; F71-E75 HydrophobicContact CZ-CG 3.61Å; F71-E75 PolarHBondContact O-N 3.14Å
72	C	83.7	Confident	81.6	Confident	61 Å²	61	109.3 Å²	109.3	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-57.9	-41.9	177.4	-66.4	0	0	0	0	112.1	M68 L69 T76	M68-C72 PolarHBondContact O-N 3.3Å; M68-C72 PolarHBondContact O-SG 2.9Å; M68-C72 VanDerWaalsContact O-SG 3.38Å; L69-C72 PolarHBondContact O-N 3.39Å; C72-T76 WeakPolarHBondContact O-CB 3.47Å; C72-T76 PolarHBondContact O-N 3.43Å; C72-T76 PolarHBondContact O-OG1 3.26Å
73	E	88.3	Confident	81.5	Confident	98 Å²	98	108 Å²	108	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-44.4	173.4	-82.9	-165.3	-137.7	0	0	112.6	L69 F71 T76 K77	L69-E73 PolarHBondContact O-N 3.13Å; F71-E73 VanDerWaalsContact C-N 3.31Å; F71-E73 PolarHBondContact O-N 3.43Å; E73-T76 PolarHBondContact O-N 3.19Å; E73-K77 VanDerWaalsContact O-CB 3.32Å; E73-K77 WeakPolarHBondContact O-CB 3.47Å; E73-K77 WeakPolarHBondContact O-CD 3.4Å; E73-K77 VanDerWaalsContact O-CG 3.22Å; E73-K77 WeakPolarHBondContact O-CG 3.32Å; E73-K77 PolarHBondContact O-N 2.8Å; E73-K77 IonicContact OE2-NZ 2.62Å; E73-K77 PolarHBondContact OE2-NZ 2.9Å
74	K	88.1	Confident	81.2	Confident	130 Å²	130	107.1 Å²	107.1	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-42.6	-179.7	-77.3	170.1	-176.3	176.5	0	112	N70 F71 K77 K78	N70-K74 WeakPolarHBondContact O-CB 3.46Å; N70-K74 WeakPolarHBondContact O-CD 3.36Å; N70-K74 WeakPolarHBondContact O-CG 3.49Å; N70-K74 PolarHBondContact O-N 3.43Å; N70-K74 VanDerWaalsContact O-N 3.1Å; F71-K74 PolarHBondContact O-N 2.78Å; F71-K74 VanDerWaalsContact O-N 3.09Å; K74-K77 PolarHBondContact O-N 2.82Å; K74-K78 WeakPolarHBondContact O-CG 3.43Å; K74-K78 PolarHBondContact O-N 3.1Å
75	E	86.4	Confident	80.7	Confident	72 Å²	72	105.6 Å²	105.6	34%	0.336	51%	0.51	S	S	.	.	H	α-helix	trans	-68.7	-38.3	175.4	-61.3	-44.8	115.7	0	0	112	F71 K77 K78 L79	F71-E75 HydrophobicContact CD1-CG 4.37Å; F71-E75 HydrophobicContact CD2-CG 4.36Å; F71-E75 HydrophobicContact CE1-CG 3.89Å; F71-E75 HydrophobicContact CE2-CG 3.87Å; F71-E75 HydrophobicContact CZ-CG 3.61Å; F71-E75 PolarHBondContact O-N 3.14Å; E75-K77 PolarHBondContact O-N 3.27Å; E75-K78 PolarHBondContact O-N 3.47Å; E75-K78 WeakPolarHBondContact OE1-CE 3.37Å; E75-K78 IonicContact OE1-NZ 2.72Å; E75-K78 PolarHBondContact OE1-NZ 3.21Å; E75-K78 WeakPolarHBondContact OE2-CD 3.46Å; E75-K78 IonicContact OE2-NZ 2.62Å; E75-K78 PolarHBondContact OE2-NZ 2.85Å; E75-L79 WeakPolarHBondContact O-CB 3.49Å; E75-L79 PolarHBondContact O-N 2.94Å
76	T	83.4	Confident	79.6	Confident	79 Å²	79	103 Å²	103	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-44.5	173.1	-55.3	0	0	0	0	111.6	C72 E73 L79 M80	C72-T76 WeakPolarHBondContact O-CB 3.47Å; C72-T76 PolarHBondContact O-N 3.43Å; C72-T76 PolarHBondContact O-OG1 3.26Å; E73-T76 PolarHBondContact O-N 3.19Å; T76-L79 PolarHBondContact O-N 3.43Å; T76-M80 WeakPolarHBondContact O-CG 3.43Å; T76-M80 PolarHBondContact O-N 3.39Å
77	K	82.8	Confident	78.2	Confident	113 Å²	113	100.4 Å²	100.4	49%	0.491	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-40.2	177.8	-74.8	162.6	179.2	166.5	0	111.9	E73 K74 E75 M80 Q81	E73-K77 VanDerWaalsContact O-CB 3.32Å; E73-K77 WeakPolarHBondContact O-CB 3.47Å; E73-K77 WeakPolarHBondContact O-CD 3.4Å; E73-K77 VanDerWaalsContact O-CG 3.22Å; E73-K77 WeakPolarHBondContact O-CG 3.32Å; E73-K77 PolarHBondContact O-N 2.8Å; E73-K77 IonicContact OE2-NZ 2.62Å; E73-K77 PolarHBondContact OE2-NZ 2.9Å; K74-K77 PolarHBondContact O-N 2.82Å; E75-K77 PolarHBondContact O-N 3.27Å; K77-M80 HydrophobicContact CG-CE 4.31Å; K77-Q81 WeakPolarHBondContact O-CB 3.37Å; K77-Q81 PolarHBondContact O-N 3.3Å
78	K	84.7	Confident	77.1	Confident	116 Å²	116	104.6 Å²	104.6	50%	0.504	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-40.6	171.2	-74.2	168.8	177.4	174.3	0	112.6	K74 E75 Q81 R82	K74-K78 WeakPolarHBondContact O-CG 3.43Å; K74-K78 PolarHBondContact O-N 3.1Å; E75-K78 PolarHBondContact O-N 3.47Å; E75-K78 WeakPolarHBondContact OE1-CE 3.37Å; E75-K78 IonicContact OE1-NZ 2.72Å; E75-K78 PolarHBondContact OE1-NZ 3.21Å; E75-K78 WeakPolarHBondContact OE2-CD 3.46Å; E75-K78 IonicContact OE2-NZ 2.62Å; E75-K78 PolarHBondContact OE2-NZ 2.85Å; K78-Q81 PolarHBondContact O-N 3.12Å; K78-R82 WeakPolarHBondContact O-CB 3.39Å; K78-R82 PolarHBondContact O-N 3.28Å
79	L	79.3	Confident	75.6	Confident	101 Å²	101	104.1 Å²	104.1	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-51.8	-179.5	-171.8	67.5	0	0	0	110.6	E75 T76 Q81 R82 E83	E75-L79 WeakPolarHBondContact O-CB 3.49Å; E75-L79 PolarHBondContact O-N 2.94Å; T76-L79 PolarHBondContact O-N 3.43Å; L79-Q81 VanDerWaalsContact C-N 3.32Å; L79-Q81 PolarHBondContact O-N 3.14Å; L79-R82 WeakPolarHBondContact O-CB 3.29Å; L79-R82 PolarHBondContact O-N 3.17Å; L79-R82 VanDerWaalsContact O-N 3.09Å; L79-E83 PolarHBondContact O-N 2.86Å
80	M	78.3	Confident	74.3	Confident	103 Å²	103	106.2 Å²	106.2	51%	0.507	52%	0.518	S	S	.	.	H	α-helix	trans	-57.9	-42.6	174.8	-65.6	-170.5	-55.5	0	0	112.1	T76 K77 R82 E83 M84	T76-M80 WeakPolarHBondContact O-CG 3.43Å; T76-M80 PolarHBondContact O-N 3.39Å; K77-M80 HydrophobicContact CG-CE 4.31Å; M80-R82 VanDerWaalsContact C-N 3.28Å; M80-R82 PolarHBondContact O-N 3.14Å; M80-E83 PolarHBondContact O-N 3.37Å; M80-M84 WeakPolarHBondContact O-CB 3.48Å; M80-M84 WeakPolarHBondContact O-CG 3.4Å; M80-M84 PolarHBondContact O-N 3.3Å
81	Q	75.5	Confident	72.6	Confident	147 Å²	147	107.7 Å²	107.7	69%	0.687	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-35.7	177.9	-170.9	175	17.3	0	0	112.1	K77 K78 L79 S85	K77-Q81 WeakPolarHBondContact O-CB 3.37Å; K77-Q81 PolarHBondContact O-N 3.3Å; K78-Q81 PolarHBondContact O-N 3.12Å; L79-Q81 VanDerWaalsContact C-N 3.32Å; L79-Q81 PolarHBondContact O-N 3.14Å; Q81-S85 PolarHBondContact O-N 3.43Å; Q81-S85 VanDerWaalsContact O-N 3.16Å; Q81-S85 PolarHBondContact O-OG 3.48Å
82	R	74.4	Confident	70.9	Confident	176 Å²	176	106.2 Å²	106.2	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-67.3	-45.6	174.6	-169.6	179.6	-174.2	118.8	4.1	111.6	K78 L79 M80 S85 M86	K78-R82 WeakPolarHBondContact O-CB 3.39Å; K78-R82 PolarHBondContact O-N 3.28Å; L79-R82 WeakPolarHBondContact O-CB 3.29Å; L79-R82 PolarHBondContact O-N 3.17Å; L79-R82 VanDerWaalsContact O-N 3.09Å; M80-R82 VanDerWaalsContact C-N 3.28Å; M80-R82 PolarHBondContact O-N 3.14Å; R82-S85 PolarHBondContact O-N 2.86Å; R82-S85 PolarHBondContact O-OG 3.49Å; R82-M86 WeakPolarHBondContact O-CG 3.49Å; R82-M86 PolarHBondContact O-N 3.01Å
83	E	72.6	Confident	69.3	Low	114 Å²	114	109.8 Å²	109.8	53%	0.533	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-47	177.8	-69.8	175.3	156.7	0	0	111.6	L79 M80 S85 M86 D87	L79-E83 PolarHBondContact O-N 2.86Å; M80-E83 PolarHBondContact O-N 3.37Å; E83-S85 VanDerWaalsContact C-N 3.32Å; E83-S85 PolarHBondContact O-N 3.03Å; E83-M86 PolarHBondContact O-N 3.47Å; E83-D87 PolarHBondContact O-N 3.27Å
84	M	64.3	Low	67.5	Low	139 Å²	139	109.8 Å²	109.8	69%	0.685	54%	0.541	S	S	*	.	H	α-helix	trans	-53.9	-45.9	174.2	-69.8	-76.6	-70.6	0	0	112.2	M80 M86 D87 E88	M80-M84 WeakPolarHBondContact O-CB 3.48Å; M80-M84 WeakPolarHBondContact O-CG 3.4Å; M80-M84 PolarHBondContact O-N 3.3Å; M84-M86 VanDerWaalsContact C-N 3.26Å; M84-M86 PolarHBondContact O-N 3.03Å; M84-D87 PolarHBondContact O-N 2.82Å; M84-E88 PolarHBondContact O-N 3.38Å; M84-E88 VanDerWaalsContact O-N 3.17Å
85	S	67.9	Low	65.6	Low	60 Å²	60	110 Å²	110	42%	0.42	54%	0.542	S	S	.	.	H	α-helix	trans	-66	-25.8	178.8	71.9	0	0	0	0	113.8	Q81 R82 E83 S89	Q81-S85 PolarHBondContact O-N 3.43Å; Q81-S85 VanDerWaalsContact O-N 3.16Å; Q81-S85 PolarHBondContact O-OG 3.48Å; R82-S85 PolarHBondContact O-N 2.86Å; R82-S85 PolarHBondContact O-OG 3.49Å; E83-S85 VanDerWaalsContact C-N 3.32Å; E83-S85 PolarHBondContact O-N 3.03Å; S85-S89 PolarHBondContact O-OG 3.06Å
86	M	55.5	Low	63.6	Low	105 Å²	105	111 Å²	111	52%	0.517	55%	0.553	S	S	.	*	H	α-helix	trans	-79.3	-26.7	177	-71.8	-177.1	63.8	0	0	112.9	R82 E83 M84 K90	R82-M86 WeakPolarHBondContact O-CG 3.49Å; R82-M86 PolarHBondContact O-N 3.01Å; E83-M86 PolarHBondContact O-N 3.47Å; M84-M86 VanDerWaalsContact C-N 3.26Å; M84-M86 PolarHBondContact O-N 3.03Å; M86-K90 WeakPolarHBondContact O-CG 3.48Å
87	D	56.1	Low	61.7	Low	85 Å²	85	114 Å²	114	46%	0.455	57%	0.566	S	S	.	*	H	α-helix	trans	-86.6	-31.3	177.1	-83.4	-6.5	0	0	0	113.4	E83 M84 S89 K90 Q91	E83-D87 PolarHBondContact O-N 3.27Å; M84-D87 PolarHBondContact O-N 2.82Å; D87-S89 PolarHBondContact O-N 3.2Å; D87-K90 PolarHBondContact O-N 2.72Å; D87-K90 WeakPolarHBondContact OD1-CE 3.44Å; D87-K90 IonicContact OD1-NZ 2.62Å; D87-K90 PolarHBondContact OD1-NZ 2.73Å; D87-Q91 PolarHBondContact O-N 2.89Å
88	E	56.3	Low	60	Low	142 Å²	142	112.8 Å²	112.8	66%	0.664	58%	0.578	S	S	*	*	H	α-helix	trans	-57.9	-41.6	166.7	-75	-167	119.7	0	0	111.2	M84 K90 Q91 V92	M84-E88 PolarHBondContact O-N 3.38Å; M84-E88 VanDerWaalsContact O-N 3.17Å; E88-K90 PolarHBondContact O-N 3.4Å; E88-Q91 PolarHBondContact O-N 2.9Å; E88-V92 PolarHBondContact O-N 3.44Å
89	S	52.4	Low	58	Low	71 Å²	71	116 Å²	116	50%	0.497	59%	0.591	S	S	.	*	H	α-helix	trans	-57.1	-46.8	178.6	-59.4	0	0	0	0	112.3	S85 D87 Q91 V92	S85-S89 PolarHBondContact O-OG 3.06Å; D87-S89 PolarHBondContact O-N 3.2Å; S89-Q91 VanDerWaalsContact C-N 3.33Å; S89-Q91 PolarHBondContact O-N 3.16Å; S89-V92 PolarHBondContact O-N 3.49Å
90	K	55.3	Low	56.1	Low	110 Å²	110	118.9 Å²	118.9	48%	0.478	61%	0.607	S	S	.	*	H	α-helix	trans	-66.8	-31.2	178.3	-61.9	168.5	-163.6	160.3	0	113.2	M86 D87 E88 V92 T94	M86-K90 WeakPolarHBondContact O-CG 3.48Å; D87-K90 PolarHBondContact O-N 2.72Å; D87-K90 WeakPolarHBondContact OD1-CE 3.44Å; D87-K90 IonicContact OD1-NZ 2.62Å; D87-K90 PolarHBondContact OD1-NZ 2.73Å; E88-K90 PolarHBondContact O-N 3.4Å; K90-V92 VanDerWaalsContact C-N 3.26Å; K90-V92 PolarHBondContact O-N 3.2Å; K90-T94 WeakPolarHBondContact O-CG2 3.31Å; K90-T94 PolarHBondContact O-N 3.19Å; K90-T94 PolarHBondContact O-OG1 3.05Å
91	Q	51.8	Low	54.1	Low	112 Å²	112	117.6 Å²	117.6	52%	0.523	62%	0.621	S	S	.	*	H	α-helix	trans	-75.6	-11.7	179.4	-77.8	-161.9	51.1	0	0	114.1	D87 E88 S89 K95	D87-Q91 PolarHBondContact O-N 2.89Å; E88-Q91 PolarHBondContact O-N 2.9Å; S89-Q91 VanDerWaalsContact C-N 3.33Å; S89-Q91 PolarHBondContact O-N 3.16Å; Q91-K95 VanDerWaalsContact O-CD 3.3Å; Q91-K95 WeakPolarHBondContact O-CD 3.47Å; Q91-K95 WeakPolarHBondContact O-CG 3.37Å; Q91-K95 PolarHBondContact O-NZ 3.32Å
92	V	52.2	Low	52.1	Low	97 Å²	97	120 Å²	120	59%	0.588	63%	0.632	S	S	*	*	H	α-helix	trans	-86.6	-50.6	172.1	176.5	0	0	0	0	110.3	E88 S89 K90 T94 K95 T96	E88-V92 PolarHBondContact O-N 3.44Å; S89-V92 PolarHBondContact O-N 3.49Å; K90-V92 VanDerWaalsContact C-N 3.26Å; K90-V92 PolarHBondContact O-N 3.2Å; V92-T94 VanDerWaalsContact C-N 3.33Å; V92-T94 PolarHBondContact O-N 2.96Å; V92-K95 PolarHBondContact O-N 3.49Å; V92-T96 PolarHBondContact O-N 3.45Å
93	E	50.4	Low	50.3	Low	135 Å²	135	118.8 Å²	118.8	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-56.6	-45.4	-179.8	-63.8	179.9	144.9	0	0	111.8	K95 T96	E93-K95 PolarHBondContact O-N 3.24Å; E93-K95 VanDerWaalsContact O-N 3.08Å; E93-T96 PolarHBondContact O-N 3.07Å; E93-T96 PolarHBondContact O-OG1 3.19Å
94	T	50.3	Low	48.4	Very low	99 Å²	99	123.8 Å²	123.8	61%	0.607	65%	0.648	S	S	*	*	H	α-helix	trans	-65.6	-10.4	178.3	47.6	0	0	0	0	115	K90 V92	K90-T94 WeakPolarHBondContact O-CG2 3.31Å; K90-T94 PolarHBondContact O-N 3.19Å; K90-T94 PolarHBondContact O-OG1 3.05Å; V92-T94 VanDerWaalsContact C-N 3.33Å; V92-T94 PolarHBondContact O-N 2.96Å
95	K	47.9	Very low	46.9	Very low	135 Å²	135	121 Å²	121	59%	0.587	65%	0.654	S	S	*	*	H	α-helix	trans	-103.1	-13.1	176.8	-70.6	175.7	-171.8	139.6	0	113.5	Q91 V92 E93	Q91-K95 VanDerWaalsContact O-CD 3.3Å; Q91-K95 WeakPolarHBondContact O-CD 3.47Å; Q91-K95 WeakPolarHBondContact O-CG 3.37Å; Q91-K95 PolarHBondContact O-NZ 3.32Å; V92-K95 PolarHBondContact O-N 3.49Å; E93-K95 PolarHBondContact O-N 3.24Å; E93-K95 VanDerWaalsContact O-N 3.08Å
96	T	43.5	Very low	45.3	Very low	93 Å²	93	129.3 Å²	129.3	57%	0.571	68%	0.677	S	S	*	*	H	α-helix	trans	-80.3	-36.8	177.3	30.6	0	0	0	0	113.5	V92 E93	V92-T96 PolarHBondContact O-N 3.45Å; E93-T96 PolarHBondContact O-N 3.07Å; E93-T96 PolarHBondContact O-OG1 3.19Å
97	D	44.7	Very low	44.2	Very low	140 Å²	140	131 Å²	131	75%	0.749	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-74.8	-25.7	-178	-67.5	-52.1	0	0	0	113.6	K99	D97-K99 PolarHBondContact O-N 3.12Å
98	A	46.4	Very low	43.2	Very low	89 Å²	89	130.6 Å²	130.6	74%	0.736	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-73.6	13.4	-175.1	0	0	0	0	0	115.3
99	K	42.3	Very low	42.2	Very low	182 Å²	182	129 Å²	129	79%	0.791	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-126.1	-1	-169.4	-137	179.1	-176.5	-178.1	0	116.9	D97	D97-K99 PolarHBondContact O-N 3.12Å
100	N	39.6	Very low	41.5	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	72%	0.72	S	S	*	*	S	Bend	trans	-123.6	75.3	178.2	-73.7	-25.2	0	0	0	110.5
101	G	36.4	Very low	40.5	Very low	77 Å²	77	139.7 Å²	139.7	79%	0.794	74%	0.738	S	S	*	*			trans	-167.3	18.9	-170.5	0	0	0	0	0	119.5
102	E	34.7	Very low	39.6	Very low	196 Å²	196	138.9 Å²	138.9	92%	0.916	75%	0.751	S	S	*	*			trans	-127.4	108.3	175.9	-72	-165	128.8	0	0	113.2
103	E	34.8	Very low	38.8	Very low	152 Å²	152	143.3 Å²	143.3	71%	0.71	77%	0.77	S	S	*	*			trans	-154.5	134.4	142.4	-136	-164.2	-157.7	0	0	112.1
104	R	33.2	Very low	37.8	Very low	219 Å²	219	140 Å²	140	83%	0.826	77%	0.772	S	S	*	*			trans	68.1	116	164.3	-47	179.5	-158.4	-154	-3.4	119.5
105	G	32.3	Very low	38.3	Very low	79 Å²	79	141 Å²	141	81%	0.814	78%	0.78	S	S	*	*			trans	168	103.5	154	0	0	0	0	0	114.5
106	R	36.3	Very low	37.6	Very low	236 Å²	236	144.5 Å²	144.5	89%	0.891	79%	0.79	S	S	*	*			trans	-80.2	168.6	173.1	-43.6	176.9	-170.1	146.4	3.9	109.5
107	D	31.5	Very low	37.3	Very low	140 Å²	140	149.3 Å²	149.3	75%	0.749	80%	0.797	S	S	*	*			cis	-165.8	176.3	29	-138	-49.7	0	0	0	114
108	A	35.2	Very low	36.7	Very low	77 Å²	77	148.5 Å²	148.5	64%	0.636	79%	0.793	S	S	*	*			trans	64.4	95.4	151.2	0	0	0	0	0	123.7
109	S	34.7	Very low	36.4	Very low	109 Å²	109	149 Å²	149	76%	0.762	79%	0.791	S	S	*	*				68.1	118.7	118.4	-59.4	0	0	0	0	123.5
110	K	38.8	Very low	36	Very low	205 Å²	205	146.3 Å²	146.3	89%	0.891	79%	0.786	S	S	*	*				-172.2	161.2	104.9	-99.9	158.6	-172.2	170.5	0	114.7
111	K	33.6	Very low	36	Very low	199 Å²	199	146.5 Å²	146.5	87%	0.865	79%	0.786	S	S	*	*			trans	-30.1	135.2	-178.6	-61.6	174	174.9	-179.7	0	115.7
112	A	33.2	Very low	35.8	Very low	95 Å²	95	146.1 Å²	146.1	79%	0.785	78%	0.782	S	S	*	*			cis	78.1	119.9	40.2	0	0	0	0	0	116
113	L	34.7	Very low	35.7	Very low	191 Å²	191	146.8 Å²	146.8	100%	1	78%	0.782	S	S	*	*			trans	-158.3	161.4	144.6	-105.6	176.9	0	0	0	110
114	G	29.8	Very low	35.5	Very low	64 Å²	64	147.4 Å²	147.4	66%	0.66	79%	0.785	S	S	*	*			trans	-129.2	-156.6	-163	0	0	0	0	0	116.1
115	P	60.3	Low	36.2	Very low	121 Å²	121	140.7 Å²	140.7	79%	0.786	77%	0.769	S	S	*	*				-131.1	-166.1	-129.4	41.1	-24.2	0	0	0	116.1
116	R	33	Very low	36.4	Very low	209 Å²	209	145.6 Å²	145.6	79%	0.789	77%	0.768	S	S	*	*			trans	101.7	155.5	175	-59.4	174	163.2	148.8	-3.5	113.7
117	R	37.5	Very low	36.2	Very low	193 Å²	193	146.1 Å²	146.1	73%	0.728	77%	0.77	S	S	*	*			cis	-158.3	151.1	20.7	-151.5	149.8	-169.5	177.6	2.2	115.7
118	D	31.8	Very low	36	Very low	123 Å²	123	143.1 Å²	143.1	66%	0.658	77%	0.772	S	S	*	*			trans	10.1	156.7	143.6	-35.5	-22.4	0	0	0	120.3
119	S	40.8	Very low	35.8	Very low	100 Å²	100	143 Å²	143	70%	0.699	78%	0.779	S	S	*	*			cis	-165.2	-153.1	-19.2	50.1	0	0	0	0	107.7
120	D	34.1	Very low	35.6	Very low	126 Å²	126	146.4 Å²	146.4	67%	0.674	79%	0.787	S	S	*	*			cis	-169.8	178.6	6.9	-139	-57.6	0	0	0	112.8
121	L	38.3	Very low	35.4	Very low	165 Å²	165	145.9 Å²	145.9	86%	0.864	79%	0.785	S	S	*	*			trans	54.8	140.7	159.3	-58.9	177.9	0	0	0	122.2
122	G	32.5	Very low	35.2	Very low	69 Å²	69	146.2 Å²	146.2	71%	0.711	79%	0.786	S	S	*	*			cis	166.4	169	-9.5	0	0	0	0	0	116
123	K	34	Very low	35.3	Very low	210 Å²	210	145.5 Å²	145.5	91%	0.913	78%	0.776	S	S	*	*			trans	85.6	95.3	165.2	-60.2	-179.3	178.2	175.9	0	122.6
124	E	29.3	Very low	35	Very low	166 Å²	166	145.3 Å²	145.3	78%	0.776	77%	0.767	S	S	*	*				29.7	157.9	111.9	-75.7	-94.1	109.5	0	0	122.1
125	P	49.4	Very low	35.1	Very low	78 Å²	78	147.8 Å²	147.8	51%	0.506	77%	0.774	S	S	.	*			cis	-154.5	-176.4	-27.5	42.4	-23.2	0	0	0	119.3
126	K	35.5	Very low	33.8	Very low	181 Å²	181	152.8 Å²	152.8	79%	0.787	78%	0.778	S	S	*	*			trans	69.9	147.5	153.3	-76.6	155.1	-162.9	154.8	0	117.2
127	R	31.4	Very low	33.6	Very low	248 Å²	248	149.9 Å²	149.9	94%	0.936	78%	0.778	S	S	*	*			cis	-142.1	164.4	1.3	-96.1	162.9	176.4	175.2	-2.2	106.9
128	G	28.1	Very low	33.3	Very low	76 Å²	76	150.2 Å²	150.2	78%	0.784	78%	0.779	S	S	*	*			cis	157.1	150.2	-4.4	0	0	0	0	0	112.3
129	G	30.1	Very low	33.2	Very low	76 Å²	76	150.1 Å²	150.1	78%	0.784	78%	0.778	S	S	*	*			trans	89.9	148.9	175.1	0	0	0	0	0	115.2
130	L	31	Very low	32.6	Very low	179 Å²	179	153.8 Å²	153.8	94%	0.937	78%	0.784	S	S	*	*			cis	-145.2	149.2	-4.2	-153.9	73.8	0	0	0	110.4
131	K	34.3	Very low	32.4	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	79%	0.789	S	S	*	*			trans	-107.8	146.7	175.5	-60	179.2	-180	-178.6	0	110.5
132	K	31.1	Very low	31.9	Very low	205 Å²	205	152 Å²	152	89%	0.891	79%	0.789	S	S	*	*				-171.7	170.3	118	-107.5	175.9	179.7	-176.7	0	113.8
133	S	34.6	Very low	31.6	Very low	81 Å²	81	151.4 Å²	151.4	57%	0.566	78%	0.783	S	S	*	*			trans	-133.4	-168.7	-171.5	53.7	0	0	0	0	110.2
134	F	28.4	Very low	31.3	Very low	186 Å²	186	151.1 Å²	151.1	82%	0.816	78%	0.781	S	S	*	*			trans	77.3	155.1	179.4	-43.3	-73.6	0	0	0	113.5
135	S	32.3	Very low	31.1	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	78%	0.781	S	S	*	*			cis	-138.6	176.3	13.2	-58.5	0	0	0	0	113.2
136	R	32.5	Very low	30	Very low	227 Å²	227	148.4 Å²	148.4	86%	0.857	80%	0.795	S	S	*	*			trans	-85.7	173.7	161.6	-125.1	-178.2	-177.2	159.4	-2.7	110.4
137	D	28.7	Very low	29.5	Very low	147 Å²	147	149.3 Å²	149.3	79%	0.786	80%	0.802	S	S	*	*			trans	110	158.5	155.5	-58.1	-28.2	0	0	0	117.3
138	R	30.9	Very low	29.3	Very low	201 Å²	201	146.8 Å²	146.8	76%	0.758	80%	0.798	S	S	*	*			cis	178.1	123.3	-40.5	-178.8	-177.7	174.1	175.6	0.5	108.6
139	D	29.4	Very low	29.8	Very low	120 Å²	120	148.4 Å²	148.4	64%	0.642	79%	0.794	S	S	*	*			trans	55.8	166	166.9	-47.4	-21.7	0	0	0	115.3
140	E	28.8	Very low	29.8	Very low	177 Å²	177	152.4 Å²	152.4	83%	0.827	79%	0.79	S	S	*	*			cis	-157.8	161.6	-12	-137.1	-178.7	161.6	0	0	111
141	A	29.7	Very low	29.8	Very low	92 Å²	92	150.9 Å²	150.9	76%	0.76	78%	0.778	S	S	*	*			trans	60.2	170.1	158.4	0	0	0	0	0	119.8
142	D	27.8	Very low	29.6	Very low	162 Å²	162	148.6 Å²	148.6	87%	0.866	77%	0.771	S	S	*	*			cis	-153.8	171.3	-2.2	-152.9	-17.7	0	0	0	112.1
143	G	27.2	Very low	29.7	Very low	57 Å²	57	146.4 Å²	146.4	59%	0.588	76%	0.761	S	S	*	*			trans	99.9	120.8	168.4	0	0	0	0	0	115.2
144	K	26.6	Very low	29.6	Very low	203 Å²	203	150.1 Å²	150.1	88%	0.883	77%	0.773	S	S	*	*				58.7	135.1	56.3	-70.9	-178.7	178.2	169.2	0	114.2
145	S	25.4	Very low	29.8	Very low	110 Å²	110	148 Å²	148	77%	0.769	77%	0.768	S	S	*	*			cis	-173	146.5	-2.1	46.1	0	0	0	0	112.4
146	G	25.9	Very low	29.6	Very low	77 Å²	77	153.6 Å²	153.6	79%	0.794	77%	0.772	S	S	*	*			trans	66.8	170.8	165.2	0	0	0	0	0	116.4
147	E	26	Very low	29.4	Very low	200 Å²	200	145.8 Å²	145.8	94%	0.935	76%	0.762	S	S	*	*			cis	-153.7	169.3	-27.6	-143.7	176.9	161.5	0	0	108.5
148	K	26.5	Very low	29.6	Very low	196 Å²	196	146.4 Å²	146.4	85%	0.852	76%	0.764	S	S	*	*			trans	-94.5	150.3	-179.4	-62.5	-178.3	-179.6	176.5	0	111.3
149	P	37.7	Very low	29.6	Very low	110 Å²	110	141.8 Å²	141.8	71%	0.714	75%	0.754	S	S	*	*				-142.4	149.6	93	38	-21.6	0	0	0	113.6
150	K	30.3	Very low	29.7	Very low	159 Å²	159	144.7 Å²	144.7	69%	0.691	76%	0.761	S	S	*	*				60.7	147	104.9	-59	175.6	151.2	-81.1	0	115.6
151	E	31.5	Very low	29.5	Very low	147 Å²	147	139.7 Å²	139.7	69%	0.687	76%	0.757	S	S	*	*			cis	-166.2	166.3	-13.4	-108	150.2	-170.8	0	0	104.8
152	E	29.4	Very low	29.4	Very low	148 Å²	148	147 Å²	147	69%	0.692	77%	0.765	S	S	*	*			cis	-152.2	173.1	8.6	-141.3	-155.6	129.2	0	0	105.1
153	K	34.5	Very low	29.4	Very low	158 Å²	158	144.3 Å²	144.3	69%	0.687	75%	0.754	S	S	*	*			cis	-144.3	-172.2	18.3	-53.9	-163.9	154.7	173.9	0	107.9
154	I	32.9	Very low	29.5	Very low	159 Å²	159	152.5 Å²	152.5	82%	0.815	77%	0.767	S	S	*	*			cis	-129.4	135.2	-4.5	-58.2	170.4	0	0	0	105.2
155	I	31.1	Very low	29.6	Very low	141 Å²	141	147.4 Å²	147.4	72%	0.723	76%	0.763	S	S	*	*			trans	-138.3	131.7	-166.4	-67.3	-178	0	0	0	113.7
156	R	28.5	Very low	29.7	Very low	235 Å²	235	146.3 Å²	146.3	89%	0.887	76%	0.76	S	S	*	*			trans	65.1	150.1	169.6	-69.9	164.1	178.1	-177.9	-3.1	116.1
157	G	28.6	Very low	30	Very low	63 Å²	63	148.9 Å²	148.9	65%	0.649	76%	0.761	S	S	*	*			cis	149.1	-166.9	-3.2	0	0	0	0	0	111.2
158	I	33.7	Very low	30.1	Very low	160 Å²	160	144.9 Å²	144.9	82%	0.821	75%	0.746	S	S	*	*			trans	71.3	161.5	158.9	-65.2	167.6	0	0	0	114.6
159	D	29.5	Very low	30.4	Very low	103 Å²	103	142.6 Å²	142.6	55%	0.551	74%	0.736	S	S	*	*			cis	179.3	151.3	-38.2	-168.4	3.4	0	0	0	108.3
160	K	31.2	Very low	30.1	Very low	182 Å²	182	144.9 Å²	144.9	79%	0.791	73%	0.734	S	S	*	*			trans	58.1	166.4	166.2	-70	139.9	-172.7	153.8	0	120.8
161	G	25.7	Very low	30	Very low	72 Å²	72	144.4 Å²	144.4	74%	0.742	74%	0.735	S	S	*	*			trans	86	129.7	170.5	0	0	0	0	0	114.2
162	R	28.1	Very low	29.9	Very low	246 Å²	246	141.6 Å²	141.6	93%	0.928	74%	0.736	S	S	*	*			cis	72.8	129.1	14.1	-151.1	-164.7	-172.8	-176.4	4.2	116.4
163	V	27.5	Very low	29.9	Very low	104 Å²	104	138.2 Å²	138.2	63%	0.63	74%	0.742	S	S	*	*			trans	119	107	149.3	-179.9	0	0	0	0	117
164	R	28	Very low	29.6	Very low	229 Å²	229	139.5 Å²	139.5	86%	0.864	75%	0.747	S	S	*	*			trans	62.4	139.7	148.3	-62.4	169.7	-156.3	-94.4	3.9	117.2
165	A	29	Very low	29.2	Very low	97 Å²	97	138.5 Å²	138.5	80%	0.802	74%	0.743	S	S	*	*				69.3	143.8	60.3	0	0	0	0	0	112.9
166	A	28.7	Very low	29	Very low	86 Å²	86	135.1 Å²	135.1	71%	0.711	74%	0.744	S	S	*	*			cis	-160.5	-167.8	16	0	0	0	0	0	112
167	V	31	Very low	28.8	Very low	132 Å²	132	135.6 Å²	135.6	80%	0.8	75%	0.745	S	S	*	*			trans	74.6	134.2	164.4	179.7	0	0	0	0	113.4
168	D	29	Very low	28.7	Very low	116 Å²	116	136 Å²	136	62%	0.62	74%	0.742	S	S	*	*			cis	-151.9	-178.5	23.6	-132.5	-17.5	0	0	0	109.2
169	K	32	Very low	28.4	Very low	148 Å²	148	137.1 Å²	137.1	64%	0.643	74%	0.744	S	S	*	*			cis	-164	141.6	-6.6	-173.8	138.6	-103.3	146.1	0	110.5
170	K	31	Very low	28.2	Very low	157 Å²	157	138.9 Å²	138.9	68%	0.683	75%	0.749	S	S	*	*			trans	59.6	151.2	156.6	-81.4	-168.5	175.9	-73.3	0	119.8
171	E	30	Very low	28	Very low	150 Å²	150	140 Å²	140	70%	0.701	75%	0.749	S	S	*	*			cis	-178.9	168.4	-21.7	-117.6	172.5	-142.5	0	0	107.4
172	A	29.4	Very low	28.1	Very low	87 Å²	87	141.2 Å²	141.2	72%	0.719	75%	0.751	S	S	*	*			cis	-158.1	141.4	-5.1	0	0	0	0	0	111.3
173	G	27.7	Very low	28	Very low	78 Å²	78	135.7 Å²	135.7	80%	0.804	74%	0.744	S	S	*	*			trans	79.5	172.7	158.4	0	0	0	0	0	117.7
174	K	28.6	Very low	28	Very low	184 Å²	184	134.7 Å²	134.7	80%	0.8	75%	0.747	S	S	*	*			cis	-161.3	160.5	-15.4	-149.8	-174.3	171.8	-169.3	0	111.3
175	D	25	Very low	27.9	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	74%	0.741	S	S	*	*			trans	-35.1	147.6	164.2	-12.7	-57.5	0	0	0	114.1
176	G	27.5	Very low	28	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	74%	0.74	S	S	*	*			cis	130	166.7	8	0	0	0	0	0	112.2
177	R	24.5	Very low	28	Very low	244 Å²	244	139.1 Å²	139.1	92%	0.921	75%	0.749	S	S	*	*			trans	84.2	118.9	158.4	-174.8	179.4	178.9	176.2	1.6	122.1
178	A	26.1	Very low	27.9	Very low	71 Å²	71	141.3 Å²	141.3	59%	0.587	75%	0.75	S	S	*	*			trans	77.5	142.2	141.1	0	0	0	0	0	123.7
179	E	26.2	Very low	27.9	Very low	184 Å²	184	144.1 Å²	144.1	86%	0.86	76%	0.76	S	S	*	*				35.7	145.5	129.9	-55.4	170.4	133	0	0	119.8
180	E	26.7	Very low	27.9	Very low	140 Å²	140	144 Å²	144	65%	0.654	76%	0.762	S	S	*	*			cis	-161.5	156.3	27.8	-150.8	-164.8	163.4	0	0	113.1
181	R	27.1	Very low	27.9	Very low	207 Å²	207	144.2 Å²	144.2	78%	0.781	76%	0.762	S	S	*	*			trans	25.6	130.3	153.1	-75.4	175.9	-179.7	142.2	1.9	122.8
182	A	26.6	Very low	27.9	Very low	97 Å²	97	146.6 Å²	146.6	80%	0.802	77%	0.77	S	S	*	*				-179.2	120.8	112.1	0	0	0	0	0	110.1
183	V	26.4	Very low	27.8	Very low	129 Å²	129	146 Å²	146	78%	0.782	77%	0.772	S	S	*	*				82.9	121.8	55.6	174.5	0	0	0	0	114.9
184	A	28	Very low	27.8	Very low	83 Å²	83	147.7 Å²	147.7	69%	0.686	77%	0.772	S	S	*	*			trans	73.2	141.9	161.7	0	0	0	0	0	119.6
185	T	26.2	Very low	27.8	Very low	119 Å²	119	145.4 Å²	145.4	73%	0.73	77%	0.769	S	S	*	*			cis	176.7	139.8	-37.9	29.1	0	0	0	0	109.4
186	K	30	Very low	28.2	Very low	180 Å²	180	149.4 Å²	149.4	78%	0.783	77%	0.774	S	S	*	*			trans	53.1	140.5	144.6	-61.1	-179.1	177.7	-168.5	0	121.1
187	K	28.9	Very low	28.2	Very low	207 Å²	207	152.5 Å²	152.5	90%	0.9	77%	0.773	S	S	*	*				-158.2	146.1	111.8	-120	175.8	-177.6	178	0	115.4
188	E	28.8	Very low	28.5	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	77%	0.766	S	S	*	*			trans	-99.3	169.4	167.1	-63.6	166	105.6	0	0	110.2
189	E	29.9	Very low	28.5	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.822	77%	0.773	S	S	*	*			trans	-100.8	132.5	174	-78.6	-164.9	136.1	0	0	113.5
190	E	32	Very low	28.8	Very low	146 Å²	146	145.9 Å²	145.9	68%	0.682	77%	0.773	S	S	*	*			trans	63	160.1	141.6	-66.2	-143.6	122.8	0	0	120.4
191	K	31.3	Very low	29	Very low	160 Å²	160	144 Å²	144	70%	0.696	78%	0.775	S	S	*	*			cis	-160	160.2	26.7	-150.1	174.4	-162.6	79.7	0	114.6
192	K	28.1	Very low	29.2	Very low	200 Å²	200	144.7 Å²	144.7	87%	0.87	78%	0.778	S	S	*	*			trans	85.2	133	156.9	-62.6	-169.9	175.9	-177.7	0	121.6
193	G	27.7	Very low	29.4	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	77%	0.767	S	S	*	*			trans	98.6	83.3	143.4	0	0	0	0	0	116.6
194	S	27.9	Very low	29.7	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	77%	0.765	S	S	*	*				75.4	97.8	68.7	-177.2	0	0	0	0	115.7
195	D	29.2	Very low	29.8	Very low	135 Å²	135	150.2 Å²	150.2	72%	0.722	77%	0.77	S	S	*	*				-160.3	-178.8	118	-131.3	-49.8	0	0	0	113.2
196	R	34	Very low	30.2	Very low	223 Å²	223	153.6 Å²	153.6	84%	0.842	78%	0.775	S	S	*	*			trans	-76	169.2	-167.9	-61.7	147.8	-178.9	168.2	0	113.3
197	N	27.5	Very low	30.1	Very low	135 Å²	135	154.1 Å²	154.1	72%	0.722	78%	0.777	S	S	*	*			cis	-165.3	158.3	34	-162.2	26.1	0	0	0	115.5
198	T	29.1	Very low	30.2	Very low	126 Å²	126	152.6 Å²	152.6	77%	0.773	77%	0.765	S	S	*	*			trans	47.1	123	156.5	43.9	0	0	0	0	123.1
199	G	26.8	Very low	30.3	Very low	72 Å²	72	149.2 Å²	149.2	74%	0.742	75%	0.75	S	S	*	*			trans	169.5	103.3	154.1	0	0	0	0	0	117.4
200	L	31.9	Very low	30.2	Very low	163 Å²	163	148.8 Å²	148.8	85%	0.853	75%	0.748	S	S	*	*			trans	38	107.9	152.9	-52.5	177.8	0	0	0	119.2
201	S	30.9	Very low	30.1	Very low	99 Å²	99	150.2 Å²	150.2	69%	0.692	76%	0.756	S	S	*	*				54.7	134.5	84.5	75.7	0	0	0	0	115.6
202	R	31.2	Very low	29.9	Very low	222 Å²	222	150.2 Å²	150.2	84%	0.838	76%	0.756	S	S	*	*			cis	-164.5	150	38.3	-152.8	166.9	-169.9	163.7	2.4	113.8
203	D	31.9	Very low	29.8	Very low	107 Å²	107	147.8 Å²	147.8	57%	0.572	75%	0.748	S	S	*	*			trans	20.8	125.7	156.8	-68	-62.9	0	0	0	122.4
204	K	33.1	Very low	29.8	Very low	170 Å²	170	150.6 Å²	150.6	74%	0.739	75%	0.75	S	S	*	*				80	151.9	79.6	-73.7	-160.6	-156.1	95.2	0	113.7
205	D	30.3	Very low	29.9	Very low	149 Å²	149	149.2 Å²	149.2	80%	0.797	75%	0.745	S	S	*	*			cis	-160.8	178.8	49.3	-137.2	-23.4	0	0	0	117.7
206	K	34	Very low	29.8	Very low	190 Å²	190	151.7 Å²	151.7	83%	0.826	75%	0.75	S	S	*	*			trans	-110.3	151.5	171.9	-69.3	-179.6	175.9	-178.9	0	112.3
207	K	28.1	Very low	29.5	Very low	191 Å²	191	148 Å²	148	83%	0.83	74%	0.74	S	S	*	*			trans	-160.8	157.8	152.3	-89.4	-149.9	177.7	178.6	0	110.9
208	R	31.5	Very low	29.6	Very low	175 Å²	175	148 Å²	148	66%	0.66	74%	0.736	S	S	*	*			cis	-171.2	-179.9	-25.8	-157.2	-171	149.6	-140.2	-17.4	107.1
209	E	29.7	Very low	29.6	Very low	106 Å²	106	149.1 Å²	149.1	50%	0.495	74%	0.737	S	S	.	*			trans	72.8	148.1	165.6	-36.2	-52.5	26.2	0	0	117.9
210	E	28.5	Very low	30	Very low	167 Å²	167	151.1 Å²	151.1	78%	0.78	73%	0.73	S	S	*	*			cis	-153.4	177.7	-15	-124.5	168.8	175.7	0	0	113.7
211	M	29	Very low	29.9	Very low	176 Å²	176	150.6 Å²	150.6	87%	0.867	72%	0.723	S	S	*	*			trans	-84.5	173.6	168.6	-83.4	-176.7	172.8	0	0	110.8
212	K	26.9	Very low	29.9	Very low	160 Å²	160	152.3 Å²	152.3	70%	0.696	72%	0.718	S	S	*	*			cis	170.4	157.7	-18.6	-176.6	-153	179.8	-157.2	0	105.1
213	E	26.2	Very low	30.1	Very low	149 Å²	149	148.3 Å²	148.3	70%	0.696	72%	0.719	S	S	*	*			trans	69.1	161.2	169.9	-77	168.5	-140.2	0	0	118.2
214	V	28.2	Very low	30	Very low	133 Å²	133	150.7 Å²	150.7	81%	0.806	72%	0.724	S	S	*	*			cis	-166.1	151.4	-46.9	120.3	0	0	0	0	112.2
215	A	29.8	Very low	29.7	Very low	85 Å²	85	146 Å²	146	70%	0.702	72%	0.723	S	S	*	*			trans	81.9	131.4	156.7	0	0	0	0	0	125.2
216	K	27.6	Very low	29.6	Very low	188 Å²	188	146.6 Å²	146.6	82%	0.817	72%	0.721	S	S	*	*			trans	98.7	123.7	135.7	-86.7	177.3	177.7	177.7	0	123.9
217	K	28.1	Very low	29.4	Very low	145 Å²	145	148.8 Å²	148.8	63%	0.63	73%	0.725	S	S	*	*			trans	74.5	117.7	141.8	-70.6	-175.8	159.5	-77.3	0	118.7
218	E	29.6	Very low	29.6	Very low	136 Å²	136	150.7 Å²	150.7	64%	0.636	73%	0.726	S	S	*	*				82.8	142.8	92.1	-72.4	162.5	-169.9	0	0	112.5
219	D	28.7	Very low	29.4	Very low	149 Å²	149	148.5 Å²	148.5	80%	0.797	73%	0.728	S	S	*	*			cis	-169.1	176.2	-7.8	-107.6	7.3	0	0	0	106.6
220	D	33.9	Very low	29.3	Very low	113 Å²	113	149 Å²	149	60%	0.604	74%	0.738	S	S	*	*			cis	-165.1	-164.4	1.1	156.4	43.2	0	0	0	106.7	K222	D220-K222 VanDerWaalsContact CG-CE 3.42Å; D220-K222 WeakPolarHBondContact OD1-CE 3.4Å; D220-K222 IonicContact OD1-NZ 3.85Å; D220-K222 WeakPolarHBondContact OD2-CE 3.33Å; D220-K222 IonicContact OD2-NZ 3.72Å; D220-K222 PolarHBondContact OD2-NZ 2.62Å
221	E	30.1	Very low	29.3	Very low	152 Å²	152	148.3 Å²	148.3	71%	0.71	74%	0.74	S	S	*	*			trans	94	103.3	174.2	-50.8	-116.9	105.2	0	0	116
222	K	32	Very low	29.2	Very low	135 Å²	135	145.2 Å²	145.2	59%	0.587	73%	0.731	S	S	*	*				83.6	150.6	64.8	-72.1	162.5	-128.5	155.1	0	112.3	D220	D220-K222 VanDerWaalsContact CG-CE 3.42Å; D220-K222 WeakPolarHBondContact OD1-CE 3.4Å; D220-K222 IonicContact OD1-NZ 3.85Å; D220-K222 WeakPolarHBondContact OD2-CE 3.33Å; D220-K222 IonicContact OD2-NZ 3.72Å; D220-K222 PolarHBondContact OD2-NZ 2.62Å
223	V	35.2	Very low	29.3	Very low	139 Å²	139	148.7 Å²	148.7	84%	0.842	74%	0.74	S	S	*	*			cis	-156.2	175.6	9.3	-117.7	0	0	0	0	108.2
224	K	28.9	Very low	29.5	Very low	157 Å²	157	149 Å²	149	68%	0.683	74%	0.739	S	S	*	*			cis	-162.8	130.8	-6.7	168.1	-98.8	-165	-172	0	110.7	E226	K224-E226 WeakPolarHBondContact CE-OE2 3.42Å; K224-E226 IonicContact NZ-OE2 2.87Å; K224-E226 PolarHBondContact NZ-OE2 3.31Å
225	G	27.5	Very low	29.5	Very low	70 Å²	70	150.1 Å²	150.1	72%	0.722	74%	0.735	S	S	*	*			trans	87.2	157	143.8	0	0	0	0	0	119.4
226	E	27.1	Very low	29.4	Very low	163 Å²	163	149.7 Å²	149.7	76%	0.762	74%	0.739	S	S	*	*			cis	-149.8	-172.1	-1.8	-127.2	166.8	135	0	0	112.6	K224	K224-E226 WeakPolarHBondContact CE-OE2 3.42Å; K224-E226 IonicContact NZ-OE2 2.87Å; K224-E226 PolarHBondContact NZ-OE2 3.31Å
227	R	31.4	Very low	29.6	Very low	236 Å²	236	147.7 Å²	147.7	89%	0.891	73%	0.733	S	S	*	*			trans	-133.4	177.2	-167.8	-68.7	-177.8	172.9	-177.6	-1.3	113.5
228	R	32.5	Very low	29.7	Very low	230 Å²	230	147.9 Å²	147.9	87%	0.868	73%	0.733	S	S	*	*			trans	88.7	152.6	163.3	-65.6	177.6	-176.5	157	0.5	115.5
229	N	26.1	Very low	29.6	Very low	130 Å²	130	147.3 Å²	147.3	70%	0.695	73%	0.732	S	S	*	*			cis	-144	146.8	2.4	-102.8	-7.6	0	0	0	107.7
230	T	27	Very low	29.8	Very low	116 Å²	116	147.1 Å²	147.1	71%	0.712	72%	0.724	S	S	*	*				65	98.5	70.2	74.1	0	0	0	0	119
231	D	28.6	Very low	29.5	Very low	153 Å²	153	151.9 Å²	151.9	82%	0.818	73%	0.734	S	S	*	*			trans	81.9	157.5	130	-130.7	-33.6	0	0	0	123.9
232	T	27.9	Very low	29.5	Very low	111 Å²	111	148.9 Å²	148.9	68%	0.681	74%	0.735	S	S	*	*			trans	85.7	104.7	160.4	59.6	0	0	0	0	124.3
233	R	29.3	Very low	29.3	Very low	232 Å²	232	146.6 Å²	146.6	88%	0.875	75%	0.75	S	S	*	*				55.8	131.1	118.9	-66.2	-179.9	173.3	175.9	-1.4	124.7
234	K	30.1	Very low	29	Very low	156 Å²	156	143.3 Å²	143.3	68%	0.678	74%	0.744	S	S	*	*				90.5	122	128.9	-95.9	-162.8	168.3	-137.7	0	123.9
235	E	28.2	Very low	29.1	Very low	157 Å²	157	142.7 Å²	142.7	73%	0.734	75%	0.748	S	S	*	*				65.5	135.7	128.5	-80.2	168.4	-162.7	0	0	124.8
236	G	28.1	Very low	29.4	Very low	75 Å²	75	144.5 Å²	144.5	77%	0.773	75%	0.745	S	S	*	*			trans	101	151.4	149.8	0	0	0	0	0	116.8
237	E	31.2	Very low	29.7	Very low	147 Å²	147	142.3 Å²	142.3	69%	0.687	74%	0.739	S	S	*	*			cis	-167.3	151.8	-25.2	-140.8	-155.7	153	0	0	110.2
238	K	29.6	Very low	29.7	Very low	148 Å²	148	137.7 Å²	137.7	64%	0.643	73%	0.729	S	S	*	*			trans	64	167.8	158.7	-74.9	164.4	178.6	137.6	0	115.8
239	M	29	Very low	29.7	Very low	125 Å²	125	135.7 Å²	135.7	62%	0.616	73%	0.726	S	S	*	*			cis	-158.2	136.8	0.7	-131	156.6	171.6	0	0	112.6
240	K	32	Very low	29.9	Very low	145 Å²	145	136.5 Å²	136.5	63%	0.63	72%	0.724	S	S	*	*			trans	53.6	159.2	132.5	-66.5	-177.9	-167.7	179.7	0	119.9
241	R	28.5	Very low	30.3	Very low	212 Å²	212	138 Å²	138	80%	0.8	72%	0.723	S	S	*	*			cis	-172.2	171.6	-5.6	-105.4	173.3	176.9	169.9	-5.2	105.6
242	A	29.9	Very low	30.5	Very low	90 Å²	90	136.6 Å²	136.6	74%	0.744	72%	0.716	S	S	*	*			cis	-166.9	147.3	-21.1	0	0	0	0	0	107.5
243	G	27.5	Very low	30.7	Very low	86 Å²	86	137.5 Å²	137.5	89%	0.887	71%	0.712	S	S	*	*				85.8	149.9	109.7	0	0	0	0	0	114.1
244	G	28.9	Very low	30.8	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	70%	0.704	S	S	*	*			cis	-140.4	-159.7	-10.9	0	0	0	0	0	108.9
245	N	30.6	Very low	30.9	Very low	145 Å²	145	132 Å²	132	78%	0.775	70%	0.704	S	S	*	*			cis	-162.1	146.1	13	-133.9	29.6	0	0	0	111.5
246	T	33.8	Very low	31.1	Very low	108 Å²	108	133.9 Å²	133.9	66%	0.663	71%	0.709	S	S	*	*			trans	55.6	162.4	145.9	64.5	0	0	0	0	121
247	D	33.9	Very low	31.1	Very low	116 Å²	116	141.8 Å²	141.8	62%	0.62	72%	0.716	S	S	*	*			cis	-155	168.4	22.2	-135.1	-48.2	0	0	0	116
248	M	31.9	Very low	30.9	Very low	140 Å²	140	138 Å²	138	69%	0.69	72%	0.716	S	S	*	*			trans	60	142.2	162.7	-62.8	-73.8	115	0	0	119.8
249	K	31.2	Very low	30.9	Very low	187 Å²	187	138.4 Å²	138.4	81%	0.813	73%	0.731	S	S	*	*			cis	-160	176.8	-23.2	-143.1	-175.4	-170.4	174	0	109.4
250	K	31	Very low	30.8	Very low	147 Å²	147	135.8 Å²	135.8	64%	0.639	74%	0.736	S	S	*	*			trans	-147.5	177.8	-167.9	-167.2	176.2	165.1	-68.4	0	112.1	D252	K250-D252 IonicContact NZ-OD2 3.77Å
251	E	34.3	Very low	30.5	Very low	147 Å²	147	136.1 Å²	136.1	69%	0.687	75%	0.745	S	S	*	*			trans	79.6	153.2	160	-82.7	133.9	-138.3	0	0	119.1
252	D	34.5	Very low	30.5	Very low	125 Å²	125	131.5 Å²	131.5	67%	0.668	74%	0.74	S	S	*	*			cis	-179.2	-165.4	-31.1	-117.8	-64.6	0	0	0	107.7	K250	K250-D252 IonicContact NZ-OD2 3.77Å
253	E	31.7	Very low	30.5	Very low	130 Å²	130	133.8 Å²	133.8	61%	0.607	74%	0.74	S	S	*	*			cis	-159	146.6	0.5	-133.9	-169.2	176.6	0	0	109.8
254	K	30.4	Very low	30.7	Very low	162 Å²	162	135 Å²	135	70%	0.704	73%	0.73	S	S	*	*			trans	62	170.4	150.2	-85.6	149.1	175.5	158	0	121.2
255	V	32.2	Very low	30.8	Very low	111 Å²	111	140.7 Å²	140.7	67%	0.673	74%	0.735	S	S	*	*			cis	175.5	164.1	-34.8	123.3	0	0	0	0	110.1
256	K	33	Very low	30.8	Very low	195 Å²	195	143.2 Å²	143.2	85%	0.848	74%	0.739	S	S	*	*			trans	97.4	151.7	174	-66.4	136.9	-174.5	173.8	0	115.3
257	R	28	Very low	30.4	Very low	242 Å²	242	147 Å²	147	91%	0.913	75%	0.75	S	S	*	*			cis	-168	131.8	-17.9	165.1	-172.2	178.9	-161.1	1.2	110.6
258	G	27.9	Very low	30.1	Very low	67 Å²	67	148.6 Å²	148.6	69%	0.691	76%	0.758	S	S	*	*			trans	80.5	159.8	161.7	0	0	0	0	0	116.3
259	T	28	Very low	30.2	Very low	157 Å²	157	147.8 Å²	147.8	96%	0.963	75%	0.752	S	S	*	*			cis	-160.4	145.9	-3.1	-28.4	0	0	0	0	110
260	G	26.8	Very low	29.9	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	75%	0.747	S	S	*	*			trans	140.1	124.8	165.2	0	0	0	0	0	116.9
261	N	27.1	Very low	29.8	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	75%	0.747	S	S	*	*			trans	-63.6	154.7	175.5	-65.5	11	0	0	0	111.9
262	T	28.3	Very low	29.5	Very low	116 Å²	116	146 Å²	146	71%	0.712	75%	0.751	S	S	*	*			cis	64.8	145.6	44.6	79.1	0	0	0	0	114.2
263	D	30.3	Very low	29	Very low	138 Å²	138	147.7 Å²	147.7	74%	0.738	75%	0.752	S	S	*	*			cis	-151	-163.9	10.4	-141.5	-47.7	0	0	0	113.6
264	T	30.3	Very low	28.8	Very low	110 Å²	110	147.5 Å²	147.5	68%	0.675	76%	0.755	S	S	*	*			trans	-130.6	165.3	-172.7	64.1	0	0	0	0	115.2
265	K	30.7	Very low	28.6	Very low	190 Å²	190	148.1 Å²	148.1	83%	0.826	76%	0.761	S	S	*	*			trans	82.4	128.6	157.1	-69.6	173.2	178.5	169.1	0	122.4
266	K	31.4	Very low	29.1	Very low	199 Å²	199	147 Å²	147	87%	0.865	76%	0.756	S	S	*	*			trans	36.2	133	130.1	-69	-168.6	169.8	-165.5	0	123
267	E	26.5	Very low	28.7	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	75%	0.749	S	S	*	*				-153.8	143.2	119	-100.2	161.7	-167	0	0	107
268	N	27.1	Very low	28.7	Very low	148 Å²	148	139.8 Å²	139.8	79%	0.791	74%	0.739	S	S	*	*				68.5	127.7	62.8	-109.8	32	0	0	0	114.3
269	E	32.5	Very low	28.5	Very low	124 Å²	124	142.4 Å²	142.4	58%	0.579	73%	0.733	S	S	*	*			cis	-123.8	-109.8	1.4	-57.5	153.4	41.5	0	0	112.7
270	K	26.4	Very low	28.5	Very low	160 Å²	160	142.3 Å²	142.3	70%	0.696	72%	0.719	S	S	*	*			cis	-156.7	90.6	-7.2	-151.7	146.3	-167.8	130.3	0	117.5
271	V	28.7	Very low	28.3	Very low	106 Å²	106	146.9 Å²	146.9	64%	0.642	72%	0.722	S	S	*	*				69.2	126.9	129.5	177.1	0	0	0	0	123.2
272	K	28.2	Very low	28.3	Very low	178 Å²	178	143.7 Å²	143.7	77%	0.774	72%	0.717	S	S	*	*			trans	75.5	118.2	156.9	-78.7	172.3	-176	178.7	0	118.8
273	K	24.4	Very low	28.2	Very low	160 Å²	160	146.1 Å²	146.1	70%	0.696	72%	0.717	S	S	*	*				93.3	145.9	90.6	-86.5	-175	147.7	-75.9	0	111.6
274	D	26.8	Very low	27.9	Very low	125 Å²	125	146.9 Å²	146.9	67%	0.668	72%	0.716	S	S	*	*			cis	-142.4	162.2	3.5	-104.2	-41.9	0	0	0	111.4
275	E	25.9	Very low	27.7	Very low	176 Å²	176	147.6 Å²	147.6	82%	0.822	72%	0.716	S	S	*	*			trans	-97.4	-175.4	166.1	-124.5	-172.8	-148.3	0	0	108.9
276	P	42.5	Very low	27.5	Very low	88 Å²	88	142.6 Å²	142.6	57%	0.571	71%	0.705	S	S	*	*			cis	-139.9	-162	-9.3	23	4.8	0	0	0	114.7
277	L	25.5	Very low	27.3	Very low	135 Å²	135	141.4 Å²	141.4	71%	0.707	70%	0.7	S	S	*	*			trans	101.5	131.2	143.7	-58.1	-177.3	0	0	0	121.8
278	H	26.3	Very low	27.1	Very low	150 Å²	150	138.2 Å²	138.2	69%	0.694	69%	0.693	S	S	*	*			trans	56.9	146.6	137.7	-72.4	-61.8	0	0	0	120.3
279	E	25.4	Very low	27.2	Very low	121 Å²	121	140.3 Å²	140.3	57%	0.565	70%	0.696	S	S	*	*			cis	-167.4	166.8	-10.9	-138.9	173.5	-140.2	0	0	110.1
280	K	26.3	Very low	26.8	Very low	156 Å²	156	140.4 Å²	140.4	68%	0.678	71%	0.705	S	S	*	*			trans	64.2	169	152.4	-78.3	168.6	179.7	141.7	0	118.4
281	E	23.6	Very low	27.3	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	71%	0.706	S	S	*	*			cis	-163.5	177.7	-44.1	-116.3	178.6	158.8	0	0	107.8
282	A	26.8	Very low	27.3	Very low	85 Å²	85	140 Å²	140	70%	0.702	71%	0.708	S	S	*	*			trans	70.3	139.8	175.1	0	0	0	0	0	116.2
283	K	25.5	Very low	27.4	Very low	166 Å²	166	137.8 Å²	137.8	72%	0.722	70%	0.698	S	S	*	*			cis	71.7	147.1	43.8	-63.4	173.3	151.3	-74	0	112.9
284	E	25.7	Very low	27.6	Very low	154 Å²	154	138 Å²	138	72%	0.72	70%	0.702	S	S	*	*			cis	-170.1	158.9	-13	-105.8	152.8	-176.1	0	0	105.6
285	D	26	Very low	27.8	Very low	126 Å²	126	140.1 Å²	140.1	67%	0.674	71%	0.71	S	S	*	*			cis	-151.9	176.8	-1.4	168.7	45.2	0	0	0	107.7
286	S	26.5	Very low	28.8	Very low	84 Å²	84	137.3 Å²	137.3	59%	0.587	71%	0.707	S	S	*	*			trans	106.4	123.4	137.5	84.1	0	0	0	0	121
287	K	26.4	Very low	28.2	Very low	174 Å²	174	137.9 Å²	137.9	76%	0.757	71%	0.713	S	S	*	*				49.7	140.4	120.5	-58.7	168.2	-173.5	148	0	118.5
288	T	23.3	Very low	28.4	Very low	121 Å²	121	134.9 Å²	134.9	74%	0.742	71%	0.714	S	S	*	*			cis	-168.7	171.8	27.7	-15.5	0	0	0	0	113.4
289	K	28.3	Very low	29.1	Very low	193 Å²	193	133.7 Å²	133.7	84%	0.839	72%	0.72	S	S	*	*			trans	82.1	102.5	150.1	-75.9	172.7	-179.3	179.5	0	121
290	T	23.7	Very low	29.3	Very low	125 Å²	125	134 Å²	134	77%	0.767	73%	0.731	S	S	*	*			trans	-78.9	-165.2	136.1	58.9	0	0	0	0	109.5
291	P	38.4	Very low	29.7	Very low	113 Å²	113	135.7 Å²	135.7	73%	0.734	74%	0.738	S	S	*	*			cis	-86.1	-157.4	23.1	41.1	-42.3	0	0	0	112.3
292	E	28.1	Very low	30.5	Very low	144 Å²	144	133.1 Å²	133.1	67%	0.673	74%	0.735	S	S	*	*			cis	-151.3	-171.6	4.3	-139.3	-151.1	-16.6	0	0	107.4
293	K	29.9	Very low	30.9	Very low	132 Å²	132	134.4 Å²	134.4	57%	0.574	74%	0.739	S	S	*	*			cis	-158	138.6	8.7	-172.8	171.6	-155	73.4	0	112.1
294	Q	29	Very low	31.3	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	75%	0.747	S	S	*	*			trans	59.2	152.3	158	-74.3	165.7	-30.6	0	0	122.2
295	M	30.3	Very low	31.6	Very low	168 Å²	168	131.1 Å²	131.1	83%	0.828	74%	0.743	S	S	*	*			trans	-135.2	-158.5	-177.7	-43.6	168.7	59.5	0	0	108.6
296	P	47.2	Very low	32.2	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	75%	0.752	S	S	*	*			cis	-88.4	-166.5	8.7	40.7	-39.8	0	0	0	112.7
297	S	29.4	Very low	32.4	Very low	101 Å²	101	131.7 Å²	131.7	71%	0.706	76%	0.759	S	S	*	*			cis	-144.9	-179.7	9.7	-50	0	0	0	0	109.5
298	G	30.2	Very low	33.2	Very low	71 Å²	71	132.9 Å²	132.9	73%	0.732	76%	0.764	S	S	*	*			cis	118.5	118.2	-2.9	0	0	0	0	0	112.8
299	P	42	Very low	33.8	Very low	126 Å²	126	131.4 Å²	131.4	82%	0.818	76%	0.764	S	S	*	*			cis	-120.4	168.2	7.1	41.6	-28.5	0	0	0	117.5
300	T	28.9	Very low	34.7	Very low	128 Å²	128	130.8 Å²	130.8	79%	0.785	76%	0.764	S	S	*	*			trans	-33.8	164.2	163.1	53.3	0	0	0	0	118.3
301	K	34.3	Very low	35.7	Very low	191 Å²	191	133.2 Å²	133.2	83%	0.83	77%	0.766	S	S	*	*			cis	-171.4	-178.6	10.2	-126.2	-173	176.4	-172.7	0	107.8
302	P	40.5	Very low	36.1	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	77%	0.774	S	S	*	*			cis	-117.7	-174.3	-32.8	40.5	-26.7	0	0	0	111.5
303	S	36.3	Very low	37.1	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	78%	0.776	S	S	*	*			trans	-100.2	135.7	168.8	55.6	0	0	0	0	111.8
304	E	32.2	Very low	38.1	Very low	192 Å²	192	131.9 Å²	131.9	90%	0.897	78%	0.782	S	S	*	*			trans	-146.2	128.8	160.7	-117.1	158.5	-140.9	0	0	108.9
305	G	32.3	Very low	39.6	Very low	60 Å²	60	129.7 Å²	129.7	62%	0.619	78%	0.782	S	S	*	*			trans	-92.4	156.7	170.5	0	0	0	0	0	109.9	A307	G305-A307 PolarHBondContact O-N 2.95Å
306	P	38.2	Very low	41.9	Very low	134 Å²	134	123.4 Å²	123.4	87%	0.87	76%	0.755	S	S	*	*			trans	-70.6	84	173.3	30.7	-34.3	0	0	0	109.6
307	A	32.4	Very low	43.8	Very low	88 Å²	88	124.2 Å²	124.2	73%	0.727	75%	0.751	S	S	*	*			trans	-54.7	138.9	156.8	0	0	0	0	0	107.7	G305 A309	G305-A307 PolarHBondContact O-N 2.95Å; A307-A309 VanDerWaalsContact C-N 3.3Å; A307-A309 PolarHBondContact O-N 2.79Å
308	K	41.7	Very low	46.6	Very low	199 Å²	199	120.1 Å²	120.1	87%	0.865	72%	0.721	S	S	*	*			trans	-67.3	96.1	168.4	-72.6	-176	175.8	-174.2	0	107.8	E310	K308-E310 VanDerWaalsContact C-N 3.34Å; K308-E310 PolarHBondContact O-N 3.32Å; K308-E310 VanDerWaalsContact O-N 3.09Å
309	A	36.3	Very low	49.4	Very low	90 Å²	90	119.6 Å²	119.6	74%	0.744	70%	0.701	S	S	*	*			trans	-64.8	103.4	154.7	0	0	0	0	0	106.4	A307 E311	A307-A309 VanDerWaalsContact C-N 3.3Å; A307-A309 PolarHBondContact O-N 2.79Å; A309-E311 PolarHBondContact O-N 2.62Å
310	E	47.1	Very low	51.8	Low	180 Å²	180	120.1 Å²	120.1	84%	0.841	69%	0.693	S	S	*	*			trans	-68.5	86	153.1	-70.5	178.7	163.4	0	0	105.4	K308 E312	K308-E310 VanDerWaalsContact C-N 3.34Å; K308-E310 PolarHBondContact O-N 3.32Å; K308-E310 VanDerWaalsContact O-N 3.09Å; E310-E312 PolarHBondContact O-N 2.86Å; E310-E312 VanDerWaalsContact O-N 3.15Å
311	E	44.3	Very low	54.8	Low	175 Å²	175	116 Å²	116	82%	0.818	67%	0.668	S	S	*	*			trans	-57.9	113.7	169.5	-176.8	172.2	-169.9	0	0	106.7	A309 A313	A309-E311 PolarHBondContact O-N 2.62Å; E311-A313 PolarHBondContact O-N 2.93Å
312	E	47.7	Very low	57.7	Low	189 Å²	189	107.2 Å²	107.2	88%	0.883	63%	0.63	S	S	*	*			trans	-56.2	105.3	175.6	-80.2	-168.8	118	0	0	107.8	E310 A314	E310-E312 PolarHBondContact O-N 2.86Å; E310-E312 VanDerWaalsContact O-N 3.15Å; E312-A314 PolarHBondContact O-N 3.27Å
313	A	49	Very low	60.2	Low	89 Å²	89	106 Å²	106	74%	0.736	62%	0.615	S	S	*	*			trans	-61.1	109.3	-176.3	0	0	0	0	0	108.4	E311	E311-A313 PolarHBondContact O-N 2.93Å
314	A	51	Low	63	Low	83 Å²	83	104.7 Å²	104.7	69%	0.686	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-51.9	129.7	171.7	0	0	0	0	0	107.9	E312 S316	E312-A314 PolarHBondContact O-N 3.27Å; A314-S316 PolarHBondContact O-N 3.05Å
315	P	61.4	Low	66	Low	121 Å²	121	95.5 Å²	95.5	79%	0.786	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-53.6	117.5	-166.1	18.6	-32.1	0	0	0	110
316	S	78	Confident	69	Low	36 Å²	36	97.1 Å²	97.1	25%	0.252	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-66.3	144.6	-175.2	-172.8	0	0	0	0	108.7	A314 F318 D319	A314-S316 PolarHBondContact O-N 3.05Å; S316-F318 PolarHBondContact O-N 2.85Å; S316-D319 WeakPolarHBondContact CB-OD2 3.49Å; S316-D319 PolarHBondContact N-OD2 3.47Å; S316-D319 WeakPolarHBondContact O-CB 3.44Å; S316-D319 PolarHBondContact O-N 3.28Å
317	I	86.1	Confident	71.7	Confident	133 Å²	133	96.6 Å²	96.6	68%	0.682	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.5	175.3	-164.4	166.4	0	0	0	112.7	P321	I317-P321 WeakPolarHBondContact O-CD 3.48Å
318	F	88.5	Confident	74.7	Confident	15 Å²	15	94.9 Å²	94.9	7%	0.066	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-12.5	175.9	-56.3	-66	0	0	0	114.5	S316 P321 L322 V337 I343 I347 F351	S316-F318 PolarHBondContact O-N 2.85Å; F318-P321 WeakPolarHBondContact O-CD 3.42Å; F318-L322 WeakPolarHBondContact O-CB 3.28Å; F318-L322 PolarHBondContact O-N 3.48Å; F318-V337 HydrophobicContact CD1-CG1 4.17Å; F318-V337 HydrophobicContact CE1-CG1 4.14Å; F318-I343 HydrophobicContact CD1-CD1 3.95Å; F318-I343 HydrophobicContact CD1-CG1 4.42Å; F318-I343 HydrophobicContact CD2-CB 4.47Å; F318-I343 HydrophobicContact CD2-CD1 4.46Å; F318-I343 HydrophobicContact CD2-CG1 4.06Å; F318-I343 HydrophobicContact CE1-CB 4.4Å; F318-I343 HydrophobicContact CE1-CD1 3.89Å; F318-I343 HydrophobicContact CE1-CG1 4.28Å; F318-I343 HydrophobicContact CE2-CB 3.81Å; F318-I343 HydrophobicContact CE2-CD1 4.41Å; F318-I343 HydrophobicContact CE2-CG1 3.91Å; F318-I343 HydrophobicContact CG-CD1 4.25Å; F318-I343 HydrophobicContact CG-CG1 4.33Å; F318-I343 HydrophobicContact CZ-CB 3.79Å; F318-I343 HydrophobicContact CZ-CD1 4.14Å; F318-I343 HydrophobicContact CZ-CG1 4.04Å; F318-I347 HydrophobicContact CB-CG2 3.73Å; F318-I347 HydrophobicContact CD2-CD1 4.11Å; F318-I347 HydrophobicContact CD2-CG2 4.17Å; F318-I347 HydrophobicContact CG-CG2 4.01Å; F318-F351 HydrophobicContact CB-CE2 3.94Å; F318-F351 HydrophobicContact CB-CZ 4.04Å; F318-F351 HydrophobicContact CD1-CE2 4.28Å; F318-F351 HydrophobicContact CG-CE2 4.37Å
319	D	90.1	Very high	77.2	Confident	60 Å²	60	87 Å²	87	32%	0.321	48%	0.475	S	S	.	.	H	α-helix	trans	-71.7	-43.1	-173.2	-67	-20.4	0	0	0	112.3	S316 L322 E323	S316-D319 WeakPolarHBondContact CB-OD2 3.49Å; S316-D319 PolarHBondContact N-OD2 3.47Å; S316-D319 WeakPolarHBondContact O-CB 3.44Å; S316-D319 PolarHBondContact O-N 3.28Å; D319-L322 PolarHBondContact O-N 3.11Å; D319-E323 WeakPolarHBondContact O-CG 3.32Å; D319-E323 PolarHBondContact O-N 3.31Å
320	E	92	Very high	79.9	Confident	138 Å²	138	87.8 Å²	87.8	65%	0.645	47%	0.473	S	S	*	.	H	α-helix	trans	-60.4	-52	173	174.6	-165.7	158.9	0	0	111.4	L322 E323 R324	E320-L322 VanDerWaalsContact C-N 3.28Å; E320-L322 PolarHBondContact O-N 3.21Å; E320-E323 PolarHBondContact O-N 2.93Å; E320-R324 WeakPolarHBondContact O-CG 3.31Å; E320-R324 PolarHBondContact O-N 3.43Å
321	P	92.3	Very high	82.2	Confident	40 Å²	40	86.4 Å²	86.4	26%	0.26	47%	0.467	S	S	.	.	H	α-helix	trans	-55	-39	172.1	-28.1	34.1	0	0	0	114.1	I317 F318 R324 V325 F351	I317-P321 WeakPolarHBondContact O-CD 3.48Å; F318-P321 WeakPolarHBondContact O-CD 3.42Å; P321-R324 PolarHBondContact O-N 3.13Å; P321-V325 VanDerWaalsContact O-CG2 3.28Å; P321-V325 WeakPolarHBondContact O-CG2 3.38Å; P321-V325 PolarHBondContact O-N 2.86Å; P321-F351 HydrophobicContact CB-CE1 4.25Å; P321-F351 HydrophobicContact CB-CZ 4.17Å
322	L	94.4	Very high	84.6	Confident	8 Å²	8	79.6 Å²	79.6	4%	0.042	44%	0.435	C	S	.	.	H	α-helix	trans	-66.7	-45.2	179.5	176.3	62.3	0	0	0	111.7	F318 D319 E320 V325 K326 R350 F351 A354	F318-L322 WeakPolarHBondContact O-CB 3.28Å; F318-L322 PolarHBondContact O-N 3.48Å; D319-L322 PolarHBondContact O-N 3.11Å; E320-L322 VanDerWaalsContact C-N 3.28Å; E320-L322 PolarHBondContact O-N 3.21Å; L322-V325 PolarHBondContact O-N 2.95Å; L322-K326 WeakPolarHBondContact O-CG 3.21Å; L322-K326 PolarHBondContact O-N 3.29Å; L322-R350 HydrophobicContact CD1-CB 4.05Å; L322-R350 WeakPolarHBondContact CD1-O 3.49Å; L322-R350 HydrophobicContact CD2-CB 3.76Å; L322-R350 HydrophobicContact CD2-CG 4.47Å; L322-F351 HydrophobicContact CB-CD1 4.44Å; L322-F351 HydrophobicContact CB-CE1 3.88Å; L322-F351 HydrophobicContact CB-CZ 4.1Å; L322-F351 HydrophobicContact CD1-CD1 3.89Å; L322-F351 HydrophobicContact CD1-CE1 4.2Å; L322-F351 HydrophobicContact CD1-CG 4.25Å; L322-A354 HydrophobicContact CD1-CB 3.82Å
323	E	93.8	Very high	86.8	Confident	84 Å²	84	73.1 Å²	73.1	39%	0.393	41%	0.409	S	S	.	.	H	α-helix	trans	-66.3	-37.7	175.2	-69.2	-51.3	134.9	0	0	112	D319 E320 V325 K326 N327	D319-E323 WeakPolarHBondContact O-CG 3.32Å; D319-E323 PolarHBondContact O-N 3.31Å; E320-E323 PolarHBondContact O-N 2.93Å; E323-V325 VanDerWaalsContact C-N 3.29Å; E323-V325 PolarHBondContact O-N 3.46Å; E323-K326 PolarHBondContact O-N 2.9Å; E323-K326 WeakPolarHBondContact OE1-CD 3.49Å; E323-K326 WeakPolarHBondContact OE1-CE 3.36Å; E323-K326 IonicContact OE1-NZ 3.88Å; E323-K326 PolarHBondContact OE1-NZ 2.82Å; E323-K326 WeakPolarHBondContact OE2-CD 3.16Å; E323-N327 WeakPolarHBondContact O-CB 3.37Å; E323-N327 PolarHBondContact O-N 3.05Å; E323-N327 PolarHBondContact O-ND2 2.87Å
324	R	94.9	Very high	89.1	Confident	84 Å²	84	74.5 Å²	74.5	32%	0.317	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-38.6	172.8	-69.7	179.5	71.4	170.2	4.3	112.1	E320 P321 N328 D329 E331	E320-R324 WeakPolarHBondContact O-CG 3.31Å; E320-R324 PolarHBondContact O-N 3.43Å; P321-R324 PolarHBondContact O-N 3.13Å; R324-N328 PolarHBondContact O-N 2.82Å; R324-D329 HydrophobicContact CB-CB 4.2Å; R324-D329 IonicContact CZ-OD2 2.65Å; R324-D329 IonicContact NE-OD2 2.88Å; R324-D329 PolarHBondContact NE-OD2 3.4Å; R324-D329 IonicContact NH2-OD2 3.77Å; R324-D329 PolarHBondContact NH2-OD2 3.45Å; R324-D329 WeakPolarHBondContact O-CB 3.46Å; R324-D329 PolarHBondContact O-N 3.45Å; R324-D329 VanDerWaalsContact O-N 3.13Å; R324-E331 IonicContact NH2-OE2 3.89Å
325	V	95.3	Very high	91.2	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-68.3	-44.9	174.6	172.9	0	0	0	0	112	P321 L322 E323 N327 N328 M332 V335 A354 L355 N358 V361	P321-V325 VanDerWaalsContact O-CG2 3.28Å; P321-V325 WeakPolarHBondContact O-CG2 3.38Å; P321-V325 PolarHBondContact O-N 2.86Å; L322-V325 PolarHBondContact O-N 2.95Å; E323-V325 VanDerWaalsContact C-N 3.29Å; E323-V325 PolarHBondContact O-N 3.46Å; V325-N327 PolarHBondContact O-N 3.16Å; V325-N328 PolarHBondContact O-N 3.41Å; V325-M332 HydrophobicContact CG2-CE 4.38Å; V325-M332 HydrophobicContact CG2-CG 4.06Å; V325-V335 HydrophobicContact CG2-CG2 3.46Å; V325-V335 VanDerWaalsContact CG2-CG2 3.46Å; V325-A354 HydrophobicContact CG1-CB 3.86Å; V325-L355 HydrophobicContact CG1-CD2 3.63Å; V325-L355 HydrophobicContact CG1-CG 3.94Å; V325-N358 PolarHBondContact O-ND2 2.83Å; V325-V361 HydrophobicContact CG2-CG2 4.48Å
326	K	94.8	Very high	92.8	Very high	94 Å²	94	69.7 Å²	69.7	41%	0.409	36%	0.357	S	S	.	.	H	α-helix	trans	-58.9	-45.8	175.4	-71.9	171.1	-177.5	170.8	0	111.8	L322 E323 N328 A354	L322-K326 WeakPolarHBondContact O-CG 3.21Å; L322-K326 PolarHBondContact O-N 3.29Å; E323-K326 PolarHBondContact O-N 2.9Å; E323-K326 WeakPolarHBondContact OE1-CD 3.49Å; E323-K326 WeakPolarHBondContact OE1-CE 3.36Å; E323-K326 IonicContact OE1-NZ 3.88Å; E323-K326 PolarHBondContact OE1-NZ 2.82Å; E323-K326 WeakPolarHBondContact OE2-CD 3.16Å; K326-N328 PolarHBondContact O-N 3.27Å; K326-N328 VanDerWaalsContact O-N 3.14Å; K326-N328 PolarHBondContact O-ND2 3.17Å; K326-A354 HydrophobicContact CG-CB 3.59Å
327	N	95.3	Very high	93.6	Very high	122 Å²	122	68.5 Å²	68.5	65%	0.652	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	4.3	-177.7	-71.6	-65.9	0	0	0	114.3	E323 V325 D329	E323-N327 WeakPolarHBondContact O-CB 3.37Å; E323-N327 PolarHBondContact O-N 3.05Å; E323-N327 PolarHBondContact O-ND2 2.87Å; V325-N327 PolarHBondContact O-N 3.16Å; N327-D329 VanDerWaalsContact C-N 3.29Å; N327-D329 PolarHBondContact O-N 3.25Å
328	N	94.1	Very high	94	Very high	53 Å²	53	64.4 Å²	64.4	28%	0.283	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	43.2	-179.5	-80.3	-99.6	0	0	0	113	R324 V325 K326 N358 T359	R324-N328 PolarHBondContact O-N 2.82Å; V325-N328 PolarHBondContact O-N 3.41Å; K326-N328 PolarHBondContact O-N 3.27Å; K326-N328 VanDerWaalsContact O-N 3.14Å; K326-N328 PolarHBondContact O-ND2 3.17Å; N328-N358 WeakPolarHBondContact OD1-CA 3.47Å; N328-T359 PolarHBondContact OD1-N 2.8Å; N328-T359 PolarHBondContact OD1-OG1 3.12Å
329	D	95	Very high	94.3	Very high	32 Å²	32	68.6 Å²	68.6	17%	0.171	35%	0.35	C	S	.	.			trans	-53.9	120.6	177.2	177.9	-13.4	0	0	0	111.3	R324 N327 E331 M332 V360	R324-D329 HydrophobicContact CB-CB 4.2Å; R324-D329 IonicContact CZ-OD2 2.65Å; R324-D329 IonicContact NE-OD2 2.88Å; R324-D329 PolarHBondContact NE-OD2 3.4Å; R324-D329 IonicContact NH2-OD2 3.77Å; R324-D329 PolarHBondContact NH2-OD2 3.45Å; R324-D329 WeakPolarHBondContact O-CB 3.46Å; R324-D329 PolarHBondContact O-N 3.45Å; R324-D329 VanDerWaalsContact O-N 3.13Å; N327-D329 VanDerWaalsContact C-N 3.29Å; N327-D329 PolarHBondContact O-N 3.25Å; D329-E331 PolarHBondContact O-N 2.97Å; D329-E331 WeakPolarHBondContact OD1-CB 3.29Å; D329-E331 PolarHBondContact OD1-N 3.45Å; D329-M332 HydrophobicContact CB-CB 3.95Å; D329-M332 PolarHBondContact O-N 2.89Å; D329-V360 WeakPolarHBondContact O-CG1 3.49Å
330	P	94.1	Very high	94.3	Very high	108 Å²	108	66.9 Å²	66.9	70%	0.701	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.9	-176.3	28.3	-36.5	0	0	0	114.4
331	E	94.5	Very high	94.1	Very high	150 Å²	150	65.8 Å²	65.8	70%	0.701	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-25.5	173.9	-58.9	-168.4	159.9	0	0	112.1	R324 D329 T333	R324-E331 IonicContact NH2-OE2 3.89Å; D329-E331 PolarHBondContact O-N 2.97Å; D329-E331 WeakPolarHBondContact OD1-CB 3.29Å; D329-E331 PolarHBondContact OD1-N 3.45Å; E331-T333 VanDerWaalsContact C-N 3.29Å; E331-T333 PolarHBondContact O-N 3.34Å
332	M	93.6	Very high	93.9	Very high	32 Å²	32	68.1 Å²	68.1	16%	0.158	36%	0.357	C	S	.	.			trans	-79.5	71.5	-172.9	-164.9	63.1	-175.9	0	0	112	V325 D329 E334 V335 V361	V325-M332 HydrophobicContact CG2-CE 4.38Å; V325-M332 HydrophobicContact CG2-CG 4.06Å; D329-M332 HydrophobicContact CB-CB 3.95Å; D329-M332 PolarHBondContact O-N 2.89Å; M332-E334 WeakPolarHBondContact CE-O 3.45Å; M332-V335 HydrophobicContact CE-CG2 3.92Å; M332-V361 WeakPolarHBondContact O-CG2 3.47Å
333	T	95.7	Very high	93.8	Very high	54 Å²	54	68.3 Å²	68.3	33%	0.331	36%	0.358	S	S	.	.			trans	-86.5	-19.2	-176.5	53.9	0	0	0	0	114.8	E331 V360 V361 K362	E331-T333 VanDerWaalsContact C-N 3.29Å; E331-T333 PolarHBondContact O-N 3.34Å; T333-V360 HydrophobicContact CG2-CG1 3.94Å; T333-V361 WeakPolarHBondContact O-CA 3.43Å; T333-K362 PolarHBondContact O-N 3.38Å
334	E	96.1	Very high	93.8	Very high	118 Å²	118	67.5 Å²	67.5	55%	0.551	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	124.4	-179.6	-55.2	-163.2	164.9	0	0	111.1	M332 V363	M332-E334 WeakPolarHBondContact CE-O 3.45Å; E334-V363 HydrophobicContact CB-CB 4.13Å; E334-V363 HydrophobicContact CG-CB 3.89Å; E334-V363 HydrophobicContact CG-CG2 3.92Å
335	V	95.5	Very high	93.7	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.012	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	109.5	173	178.4	0	0	0	0	108	V325 M332 F351 L355 V361 V363 F364 A365	V325-V335 HydrophobicContact CG2-CG2 3.46Å; V325-V335 VanDerWaalsContact CG2-CG2 3.46Å; M332-V335 HydrophobicContact CE-CG2 3.92Å; V335-F351 HydrophobicContact CG1-CD1 4.12Å; V335-F351 HydrophobicContact CG1-CE1 4.28Å; V335-L355 HydrophobicContact CG2-CD2 4.39Å; V335-V361 HydrophobicContact CB-CG1 4.42Å; V335-V361 HydrophobicContact CG2-CG1 3.88Å; V335-V361 HydrophobicContact CG2-CG2 3.77Å; V335-V363 PolarHBondContact N-O 3.33Å; V335-F364 HydrophobicContact CB-CD2 3.88Å; V335-F364 HydrophobicContact CB-CE2 4.48Å; V335-F364 HydrophobicContact CG1-CD2 3.72Å; V335-F364 HydrophobicContact CG1-CE2 3.83Å; V335-F364 CarbonylContact O-C 3.36Å; V335-F364 WeakPolarHBondContact O-CA 3.37Å; V335-A365 PolarHBondContact O-N 2.94Å
336	N	95.3	Very high	93.7	Very high	101 Å²	101	71.3 Å²	71.3	54%	0.54	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	112.3	-175.5	177.4	8.9	0	0	0	110.3	N338	N336-N338 WeakPolarHBondContact OD1-CB 3.46Å; N336-N338 PolarHBondContact OD1-N 3.45Å; N336-N338 VanDerWaalsContact OD1-N 3.15Å; N336-N338 PolarHBondContact OD1-ND2 2.67Å
337	V	94.4	Very high	93.7	Very high	10 Å²	10	68.2 Å²	68.2	6%	0.061	37%	0.37	C	S	.	.			trans	-120.5	22.2	177.9	-64.2	0	0	0	0	111.7	F318 S340 I343 L348 F351 A365 L366 T369	F318-V337 HydrophobicContact CD1-CG1 4.17Å; F318-V337 HydrophobicContact CE1-CG1 4.14Å; V337-S340 VanDerWaalsContact O-CB 3.28Å; V337-S340 WeakPolarHBondContact O-CB 3.35Å; V337-S340 PolarHBondContact O-N 3.18Å; V337-S340 PolarHBondContact O-OG 3.14Å; V337-I343 HydrophobicContact CB-CD1 3.81Å; V337-I343 HydrophobicContact CG1-CD1 3.91Å; V337-I343 HydrophobicContact CG2-CD1 3.86Å; V337-L348 HydrophobicContact CG2-CD2 4.02Å; V337-F351 HydrophobicContact CG1-CE2 4.29Å; V337-A365 WeakPolarHBondContact CG2-O 3.31Å; V337-A365 PolarHBondContact N-O 2.8Å; V337-L366 HydrophobicContact CG2-CB 3.71Å; V337-T369 HydrophobicContact CG2-CG2 4.27Å; V337-T369 VanDerWaalsContact O-CG2 3.23Å; V337-T369 WeakPolarHBondContact O-CG2 3.31Å
338	N	94.8	Very high	93.7	Very high	47 Å²	47	62.4 Å²	62.4	25%	0.251	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	136.5	-176.1	-64.8	-26.8	0	0	0	112.9	N336 S340 A365 L366 A367	N336-N338 WeakPolarHBondContact OD1-CB 3.46Å; N336-N338 PolarHBondContact OD1-N 3.45Å; N336-N338 VanDerWaalsContact OD1-N 3.15Å; N336-N338 PolarHBondContact OD1-ND2 2.67Å; N338-S340 VanDerWaalsContact C-N 3.25Å; N338-S340 PolarHBondContact O-N 2.69Å; N338-A365 WeakPolarHBondContact OD1-CB 3.45Å; N338-A365 PolarHBondContact OD1-O 3.05Å; N338-L366 PolarHBondContact OD1-N 3.47Å; N338-A367 CarbonylContact C-O 3.44Å; N338-A367 VanDerWaalsContact CA-O 3.24Å; N338-A367 WeakPolarHBondContact CA-O 3.44Å; N338-A367 WeakPolarHBondContact OD1-CB 3.48Å; N338-A367 PolarHBondContact OD1-N 3.03Å
339	N	94.1	Very high	93.8	Very high	104 Å²	104	60.6 Å²	60.6	56%	0.556	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	22.2	-179.5	-44.3	-78.8	0	0	0	115.2	D341 A367 N368	N339-D341 PolarHBondContact O-N 3.32Å; N339-A367 PolarHBondContact N-O 3.38Å; N339-N368 WeakPolarHBondContact CA-O 3.43Å; N339-N368 PolarHBondContact N-O 3.46Å; N339-N368 WeakPolarHBondContact OD1-CB 3.49Å; N339-N368 PolarHBondContact OD1-ND2 3.41Å
340	S	91.6	Very high	93.9	Very high	24 Å²	24	63.9 Å²	63.9	17%	0.168	34%	0.34	C	S	.	.			trans	-77.2	96.9	175.9	-60.1	0	0	0	0	111.3	V337 N338 C342 I343	V337-S340 VanDerWaalsContact O-CB 3.28Å; V337-S340 WeakPolarHBondContact O-CB 3.35Å; V337-S340 PolarHBondContact O-N 3.18Å; V337-S340 PolarHBondContact O-OG 3.14Å; N338-S340 VanDerWaalsContact C-N 3.25Å; N338-S340 PolarHBondContact O-N 2.69Å; S340-C342 PolarHBondContact O-N 2.84Å; S340-I343 WeakPolarHBondContact O-CG2 3.37Å; S340-I343 PolarHBondContact O-N 3.18Å
341	D	86.3	Confident	94	Very high	115 Å²	115	58.7 Å²	58.7	62%	0.615	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.9	175.8	-90.1	-49.1	0	0	0	114	N339 R370	N339-D341 PolarHBondContact O-N 3.32Å; D341-R370 IonicContact OD1-CZ 2.66Å; D341-R370 IonicContact OD1-NE 3.14Å; D341-R370 IonicContact OD1-NH2 2.67Å; D341-R370 PolarHBondContact OD1-NH2 2.9Å
342	C	89.1	Confident	94.1	Very high	88 Å²	88	51.7 Å²	51.7	60%	0.595	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-3.7	179.4	55.7	0	0	0	0	114.7	S340	S340-C342 PolarHBondContact O-N 2.84Å
343	I	91.6	Very high	94.2	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.062	29%	0.287	C	S	.	.			trans	-81.1	137.7	178.1	-153.6	166.1	0	0	0	110.4	F318 V337 S340 I347 L348 F351 T369	F318-I343 HydrophobicContact CD1-CD1 3.95Å; F318-I343 HydrophobicContact CD1-CG1 4.42Å; F318-I343 HydrophobicContact CD2-CB 4.47Å; F318-I343 HydrophobicContact CD2-CD1 4.46Å; F318-I343 HydrophobicContact CD2-CG1 4.06Å; F318-I343 HydrophobicContact CE1-CB 4.4Å; F318-I343 HydrophobicContact CE1-CD1 3.89Å; F318-I343 HydrophobicContact CE1-CG1 4.28Å; F318-I343 HydrophobicContact CE2-CB 3.81Å; F318-I343 HydrophobicContact CE2-CD1 4.41Å; F318-I343 HydrophobicContact CE2-CG1 3.91Å; F318-I343 HydrophobicContact CG-CD1 4.25Å; F318-I343 HydrophobicContact CG-CG1 4.33Å; F318-I343 HydrophobicContact CZ-CB 3.79Å; F318-I343 HydrophobicContact CZ-CD1 4.14Å; F318-I343 HydrophobicContact CZ-CG1 4.04Å; V337-I343 HydrophobicContact CB-CD1 3.81Å; V337-I343 HydrophobicContact CG1-CD1 3.91Å; V337-I343 HydrophobicContact CG2-CD1 3.86Å; S340-I343 WeakPolarHBondContact O-CG2 3.37Å; S340-I343 PolarHBondContact O-N 3.18Å; I343-I347 HydrophobicContact CD1-CG2 4.01Å; I343-I347 HydrophobicContact CG1-CB 3.98Å; I343-I347 HydrophobicContact CG1-CG2 3.69Å; I343-L348 HydrophobicContact CD1-CD2 3.6Å; I343-L348 HydrophobicContact CD1-CG 4.14Å; I343-L348 HydrophobicContact CG1-CD2 4.22Å; I343-L348 HydrophobicContact CG1-CG 4.22Å; I343-L348 HydrophobicContact CG2-CD1 4.41Å; I343-L348 HydrophobicContact CG2-CD2 4.35Å; I343-L348 HydrophobicContact CG2-CG 4.32Å; I343-F351 HydrophobicContact CD1-CD2 4.39Å; I343-F351 HydrophobicContact CD1-CE2 4.13Å; I343-T369 HydrophobicContact CG2-CG2 3.93Å
344	T	93.5	Very high	94.2	Very high	68 Å²	68	52.9 Å²	52.9	42%	0.417	28%	0.277	S	S	.	.			trans	-100.6	158.1	177.5	69.9	0	0	0	0	110.9	E346 I347 L348	T344-E346 PolarHBondContact O-N 2.84Å; T344-I347 HydrophobicContact CG2-CD1 4.43Å; T344-I347 PolarHBondContact O-N 3.08Å; T344-I347 VanDerWaalsContact O-N 3.11Å; T344-I347 WeakPolarHBondContact OG1-CG1 3.48Å; T344-I347 PolarHBondContact OG1-N 3.48Å; T344-L348 PolarHBondContact O-N 2.94Å
345	N	94.1	Very high	94.2	Very high	43 Å²	43	47.2 Å²	47.2	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-26.7	174.7	-70.2	-1.4	0	0	0	112.1	V349 D372 V375	N345-V349 WeakPolarHBondContact O-CG2 3.43Å; N345-V349 PolarHBondContact O-N 2.97Å; N345-D372 PolarHBondContact ND2-OD2 2.91Å; N345-V375 HydrophobicContact CB-CG2 3.81Å
346	E	94.4	Very high	94.2	Very high	121 Å²	121	49.7 Å²	49.7	57%	0.565	26%	0.263	S	S	*	.	H	α-helix	trans	-67.6	-47.1	170.9	-178.8	166	-174.9	0	0	111.7	T344 L348 V349 R350	T344-E346 PolarHBondContact O-N 2.84Å; E346-L348 VanDerWaalsContact C-N 3.28Å; E346-L348 PolarHBondContact O-N 2.87Å; E346-V349 CarbonylContact O-C 3.55Å; E346-V349 WeakPolarHBondContact O-CA 3.47Å; E346-V349 WeakPolarHBondContact O-CB 3.36Å; E346-V349 PolarHBondContact O-N 3.15Å; E346-R350 WeakPolarHBondContact O-CG 3.47Å; E346-R350 PolarHBondContact O-N 2.9Å; E346-R350 IonicContact OE1-CZ 2.65Å; E346-R350 IonicContact OE1-NE 3.78Å; E346-R350 IonicContact OE1-NH2 2.9Å; E346-R350 PolarHBondContact OE1-NH2 2.92Å
347	I	94.6	Very high	94.1	Very high	28 Å²	28	52.1 Å²	52.1	14%	0.144	27%	0.269	C	S	.	.	H	α-helix	trans	-60.7	-39.7	177	-65.9	168.6	0	0	0	110.6	F318 I343 T344 V349 R350 F351	F318-I347 HydrophobicContact CB-CG2 3.73Å; F318-I347 HydrophobicContact CD2-CD1 4.11Å; F318-I347 HydrophobicContact CD2-CG2 4.17Å; F318-I347 HydrophobicContact CG-CG2 4.01Å; I343-I347 HydrophobicContact CD1-CG2 4.01Å; I343-I347 HydrophobicContact CG1-CB 3.98Å; I343-I347 HydrophobicContact CG1-CG2 3.69Å; T344-I347 HydrophobicContact CG2-CD1 4.43Å; T344-I347 PolarHBondContact O-N 3.08Å; T344-I347 VanDerWaalsContact O-N 3.11Å; T344-I347 WeakPolarHBondContact OG1-CG1 3.48Å; T344-I347 PolarHBondContact OG1-N 3.48Å; I347-V349 VanDerWaalsContact C-N 3.35Å; I347-V349 PolarHBondContact O-N 2.85Å; I347-R350 PolarHBondContact O-N 3.1Å; I347-F351 HydrophobicContact CG2-CD2 3.96Å; I347-F351 HydrophobicContact CG2-CE2 3.7Å; I347-F351 VanDerWaalsContact O-CD2 3.27Å; I347-F351 WeakPolarHBondContact O-CD2 3.41Å; I347-F351 PolarHBondContact O-N 3.06Å
348	L	95.9	Very high	94.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-40.9	172.3	-69.3	175	0	0	0	112.3	V337 I343 T344 E346 F351 T352 L366 A371 V375	V337-L348 HydrophobicContact CG2-CD2 4.02Å; I343-L348 HydrophobicContact CD1-CD2 3.6Å; I343-L348 HydrophobicContact CD1-CG 4.14Å; I343-L348 HydrophobicContact CG1-CD2 4.22Å; I343-L348 HydrophobicContact CG1-CG 4.22Å; I343-L348 HydrophobicContact CG2-CD1 4.41Å; I343-L348 HydrophobicContact CG2-CD2 4.35Å; I343-L348 HydrophobicContact CG2-CG 4.32Å; T344-L348 PolarHBondContact O-N 2.94Å; E346-L348 VanDerWaalsContact C-N 3.28Å; E346-L348 PolarHBondContact O-N 2.87Å; L348-F351 PolarHBondContact O-N 3.04Å; L348-T352 WeakPolarHBondContact O-CG2 3.41Å; L348-T352 PolarHBondContact O-N 3.39Å; L348-L366 HydrophobicContact CD1-CD1 4.27Å; L348-L366 HydrophobicContact CD2-CB 4.01Å; L348-L366 HydrophobicContact CD2-CD1 3.97Å; L348-A371 HydrophobicContact CD1-CB 3.8Å; L348-V375 HydrophobicContact CB-CG1 3.93Å; L348-V375 HydrophobicContact CB-CG2 4Å; L348-V375 HydrophobicContact CD1-CG1 4.37Å; L348-V375 HydrophobicContact CD1-CG2 4.19Å
349	V	96.8	Very high	94.2	Very high	15 Å²	15	54.3 Å²	54.3	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-43.6	173.1	169	0	0	0	0	110.9	N345 E346 I347 F351 T352 E353 V375 A378	N345-V349 WeakPolarHBondContact O-CG2 3.43Å; N345-V349 PolarHBondContact O-N 2.97Å; E346-V349 CarbonylContact O-C 3.55Å; E346-V349 WeakPolarHBondContact O-CA 3.47Å; E346-V349 WeakPolarHBondContact O-CB 3.36Å; E346-V349 PolarHBondContact O-N 3.15Å; I347-V349 VanDerWaalsContact C-N 3.35Å; I347-V349 PolarHBondContact O-N 2.85Å; V349-F351 VanDerWaalsContact C-N 3.31Å; V349-F351 PolarHBondContact O-N 2.91Å; V349-T352 WeakPolarHBondContact CA-OG1 3.15Å; V349-T352 CarbonylContact O-C 3.56Å; V349-T352 WeakPolarHBondContact O-CA 3.36Å; V349-T352 PolarHBondContact O-N 3.49Å; V349-T352 PolarHBondContact O-OG1 3.22Å; V349-E353 HydrophobicContact CG1-CG 4.24Å; V349-E353 WeakPolarHBondContact O-CG 3.41Å; V349-E353 PolarHBondContact O-N 3.48Å; V349-V375 HydrophobicContact CG2-CG2 4.4Å; V349-A378 HydrophobicContact CG1-CB 4.47Å; V349-A378 HydrophobicContact CG2-CB 4.13Å
350	R	95.9	Very high	94.4	Very high	101 Å²	101	50.5 Å²	50.5	38%	0.381	26%	0.264	S	S	.	.	H	α-helix	trans	-57.8	-40.8	174.9	-60.9	-46.8	-178.9	-179	-2.8	112.7	L322 E346 I347 T352 E353 A354	L322-R350 HydrophobicContact CD1-CB 4.05Å; L322-R350 WeakPolarHBondContact CD1-O 3.49Å; L322-R350 HydrophobicContact CD2-CB 3.76Å; L322-R350 HydrophobicContact CD2-CG 4.47Å; E346-R350 WeakPolarHBondContact O-CG 3.47Å; E346-R350 PolarHBondContact O-N 2.9Å; E346-R350 IonicContact OE1-CZ 2.65Å; E346-R350 IonicContact OE1-NE 3.78Å; E346-R350 IonicContact OE1-NH2 2.9Å; E346-R350 PolarHBondContact OE1-NH2 2.92Å; I347-R350 PolarHBondContact O-N 3.1Å; R350-T352 VanDerWaalsContact C-N 3.35Å; R350-E353 WeakPolarHBondContact CD-OE2 3.34Å; R350-E353 IonicContact CZ-OE2 3.86Å; R350-E353 IonicContact NE-OE2 2.74Å; R350-E353 IonicContact NH1-OE1 3.53Å; R350-E353 IonicContact NH1-OE2 3.83Å; R350-E353 PolarHBondContact NH1-OE2 3.27Å; R350-E353 PolarHBondContact O-N 3.49Å; R350-A354 WeakPolarHBondContact O-CB 3.41Å; R350-A354 PolarHBondContact O-N 2.96Å
351	F	95.8	Very high	94.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-41.1	171.4	-80.8	-65.8	0	0	0	112	F318 P321 L322 V335 V337 I343 I347 L348 V349 A354 L355 F364	F318-F351 HydrophobicContact CB-CE2 3.94Å; F318-F351 HydrophobicContact CB-CZ 4.04Å; F318-F351 HydrophobicContact CD1-CE2 4.28Å; F318-F351 HydrophobicContact CG-CE2 4.37Å; P321-F351 HydrophobicContact CB-CE1 4.25Å; P321-F351 HydrophobicContact CB-CZ 4.17Å; L322-F351 HydrophobicContact CB-CD1 4.44Å; L322-F351 HydrophobicContact CB-CE1 3.88Å; L322-F351 HydrophobicContact CB-CZ 4.1Å; L322-F351 HydrophobicContact CD1-CD1 3.89Å; L322-F351 HydrophobicContact CD1-CE1 4.2Å; L322-F351 HydrophobicContact CD1-CG 4.25Å; V335-F351 HydrophobicContact CG1-CD1 4.12Å; V335-F351 HydrophobicContact CG1-CE1 4.28Å; V337-F351 HydrophobicContact CG1-CE2 4.29Å; I343-F351 HydrophobicContact CD1-CD2 4.39Å; I343-F351 HydrophobicContact CD1-CE2 4.13Å; I347-F351 HydrophobicContact CG2-CD2 3.96Å; I347-F351 HydrophobicContact CG2-CE2 3.7Å; I347-F351 VanDerWaalsContact O-CD2 3.27Å; I347-F351 WeakPolarHBondContact O-CD2 3.41Å; I347-F351 PolarHBondContact O-N 3.06Å; L348-F351 PolarHBondContact O-N 3.04Å; V349-F351 VanDerWaalsContact C-N 3.31Å; V349-F351 PolarHBondContact O-N 2.91Å; F351-A354 PolarHBondContact O-N 3.11Å; F351-L355 VanDerWaalsContact O-CB 3.31Å; F351-L355 WeakPolarHBondContact O-CB 3.42Å; F351-L355 WeakPolarHBondContact O-CD1 3.43Å; F351-L355 WeakPolarHBondContact O-CG 3.27Å; F351-L355 PolarHBondContact O-N 2.7Å; F351-F364 HydrophobicContact CB-CE2 4.27Å; F351-F364 HydrophobicContact CB-CZ 4.13Å
352	T	96.4	Very high	95.2	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-68.8	-35.5	177.7	60.9	0	0	0	0	113.7	L348 V349 R350 L355 E356 F364 A378 I379 M382	L348-T352 WeakPolarHBondContact O-CG2 3.41Å; L348-T352 PolarHBondContact O-N 3.39Å; V349-T352 WeakPolarHBondContact CA-OG1 3.15Å; V349-T352 CarbonylContact O-C 3.56Å; V349-T352 WeakPolarHBondContact O-CA 3.36Å; V349-T352 PolarHBondContact O-N 3.49Å; V349-T352 PolarHBondContact O-OG1 3.22Å; R350-T352 VanDerWaalsContact C-N 3.35Å; T352-L355 PolarHBondContact O-N 2.88Å; T352-E356 PolarHBondContact O-N 2.81Å; T352-F364 HydrophobicContact CG2-CE1 3.85Å; T352-F364 HydrophobicContact CG2-CZ 4.21Å; T352-A378 VanDerWaalsContact OG1-CB 3.29Å; T352-A378 WeakPolarHBondContact OG1-CB 3.42Å; T352-I379 HydrophobicContact CG2-CD1 4.49Å; T352-I379 HydrophobicContact CG2-CG1 3.51Å; T352-M382 WeakPolarHBondContact O-CG 3.2Å
353	E	95.9	Very high	95.6	Very high	95 Å²	95	46.5 Å²	46.5	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-49.9	171.7	-68.4	174.9	159.7	0	0	110.1	V349 R350 L355 E356	V349-E353 HydrophobicContact CG1-CG 4.24Å; V349-E353 WeakPolarHBondContact O-CG 3.41Å; V349-E353 PolarHBondContact O-N 3.48Å; R350-E353 WeakPolarHBondContact CD-OE2 3.34Å; R350-E353 IonicContact CZ-OE2 3.86Å; R350-E353 IonicContact NE-OE2 2.74Å; R350-E353 IonicContact NH1-OE1 3.53Å; R350-E353 IonicContact NH1-OE2 3.83Å; R350-E353 PolarHBondContact NH1-OE2 3.27Å; R350-E353 PolarHBondContact O-N 3.49Å; E353-L355 VanDerWaalsContact C-N 3.27Å; E353-L355 PolarHBondContact O-N 3.42Å; E353-E356 WeakPolarHBondContact O-CB 3.49Å; E353-E356 PolarHBondContact O-N 3.18Å; E353-E356 VanDerWaalsContact O-N 3.16Å
354	A	95.8	Very high	95.9	Very high	15 Å²	15	45.9 Å²	45.9	12%	0.124	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-30.7	178	0	0	0	0	0	113.4	L322 V325 K326 R350 F351	L322-A354 HydrophobicContact CD1-CB 3.82Å; V325-A354 HydrophobicContact CG1-CB 3.86Å; K326-A354 HydrophobicContact CG-CB 3.59Å; R350-A354 WeakPolarHBondContact O-CB 3.41Å; R350-A354 PolarHBondContact O-N 2.96Å; F351-A354 PolarHBondContact O-N 3.11Å
355	L	96.5	Very high	96.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-79.5	-13.4	177.1	-73.1	170.6	0	0	0	114.1	V325 V335 F351 T352 E353 F357 N358 V361 F364 M382 N386 I389	V325-L355 HydrophobicContact CG1-CD2 3.63Å; V325-L355 HydrophobicContact CG1-CG 3.94Å; V335-L355 HydrophobicContact CG2-CD2 4.39Å; F351-L355 VanDerWaalsContact O-CB 3.31Å; F351-L355 WeakPolarHBondContact O-CB 3.42Å; F351-L355 WeakPolarHBondContact O-CD1 3.43Å; F351-L355 WeakPolarHBondContact O-CG 3.27Å; F351-L355 PolarHBondContact O-N 2.7Å; T352-L355 PolarHBondContact O-N 2.88Å; E353-L355 VanDerWaalsContact C-N 3.27Å; E353-L355 PolarHBondContact O-N 3.42Å; L355-F357 VanDerWaalsContact C-N 3.28Å; L355-F357 PolarHBondContact O-N 3.24Å; L355-N358 HydrophobicContact CD2-CB 4.15Å; L355-N358 PolarHBondContact O-N 2.88Å; L355-V361 HydrophobicContact CD2-CB 3.73Å; L355-V361 HydrophobicContact CD2-CG1 3.77Å; L355-V361 HydrophobicContact CD2-CG2 3.77Å; L355-F364 HydrophobicContact CD1-CB 4.23Å; L355-F364 HydrophobicContact CD1-CD1 3.68Å; L355-F364 HydrophobicContact CD1-CD2 3.75Å; L355-F364 HydrophobicContact CD1-CE1 3.85Å; L355-F364 HydrophobicContact CD1-CE2 3.91Å; L355-F364 HydrophobicContact CD1-CG 3.63Å; L355-F364 HydrophobicContact CD1-CZ 3.95Å; L355-M382 HydrophobicContact CB-CG 3.99Å; L355-M382 HydrophobicContact CB-SD 4.48Å; L355-N386 PolarHBondContact O-ND2 2.92Å; L355-I389 HydrophobicContact CB-CD1 4.36Å; L355-I389 HydrophobicContact CD1-CD1 4.27Å; L355-I389 HydrophobicContact CD2-CD1 4.34Å
356	E	95.6	Very high	96.2	Very high	54 Å²	54	41 Å²	41	25%	0.252	20%	0.2	S	C	.	.	S	Bend	trans	-58.2	-41.1	-176.8	-169.4	171.7	-161.1	0	0	112.4	T352 E353 A385 N386	T352-E356 PolarHBondContact O-N 2.81Å; E353-E356 WeakPolarHBondContact O-CB 3.49Å; E353-E356 PolarHBondContact O-N 3.18Å; E353-E356 VanDerWaalsContact O-N 3.16Å; E356-A385 HydrophobicContact CG-CB 3.47Å; E356-A385 VanDerWaalsContact CG-CB 3.47Å; E356-N386 PolarHBondContact O-N 3.23Å
357	F	92.9	Very high	96.3	Very high	152 Å²	152	35.9 Å²	35.9	67%	0.667	18%	0.178	S	C	*	.	S	Bend	trans	-112.7	7.5	-179.8	-53.9	-76.8	0	0	0	113.7	L355	L355-F357 VanDerWaalsContact C-N 3.28Å; L355-F357 PolarHBondContact O-N 3.24Å
358	N	95.5	Very high	96.4	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.016	19%	0.188	C	C	.	.			trans	-70.7	139.2	178.3	-175.5	-75	0	0	0	111.3	V325 N328 L355 V360 V361 N386 T388	V325-N358 PolarHBondContact O-ND2 2.83Å; N328-N358 WeakPolarHBondContact OD1-CA 3.47Å; L355-N358 HydrophobicContact CD2-CB 4.15Å; L355-N358 PolarHBondContact O-N 2.88Å; N358-V360 PolarHBondContact OD1-N 2.88Å; N358-V361 WeakPolarHBondContact OD1-CB 3.38Å; N358-V361 WeakPolarHBondContact OD1-CG2 3.47Å; N358-V361 PolarHBondContact OD1-N 3.43Å; N358-N386 PolarHBondContact O-ND2 2.85Å; N358-N386 VanDerWaalsContact O-ND2 3.1Å; N358-T388 PolarHBondContact O-OG1 2.9Å
359	T	95.9	Very high	96.3	Very high	99 Å²	99	37.9 Å²	37.9	61%	0.607	19%	0.189	S	C	*	.	S	Bend	trans	-114.7	0.3	-174.2	58.3	0	0	0	0	114.9	N328	N328-T359 PolarHBondContact OD1-N 2.8Å; N328-T359 PolarHBondContact OD1-OG1 3.12Å
360	V	97.3	Very high	96.3	Very high	24 Å²	24	43.8 Å²	43.8	15%	0.145	21%	0.21	C	C	.	.	S	Bend	trans	-111.3	-40.3	-174.1	-174.8	0	0	0	0	112.1	D329 T333 N358 K362	D329-V360 WeakPolarHBondContact O-CG1 3.49Å; T333-V360 HydrophobicContact CG2-CG1 3.94Å; N358-V360 PolarHBondContact OD1-N 2.88Å; V360-K362 PolarHBondContact O-N 3.28Å
361	V	97.6	Very high	96.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.192	C	C	.	.			trans	-67.5	127.6	-175.5	178.3	0	0	0	0	110.3	V325 M332 T333 V335 L355 N358 V363 T388 I389	V325-V361 HydrophobicContact CG2-CG2 4.48Å; M332-V361 WeakPolarHBondContact O-CG2 3.47Å; T333-V361 WeakPolarHBondContact O-CA 3.43Å; V335-V361 HydrophobicContact CB-CG1 4.42Å; V335-V361 HydrophobicContact CG2-CG1 3.88Å; V335-V361 HydrophobicContact CG2-CG2 3.77Å; L355-V361 HydrophobicContact CD2-CB 3.73Å; L355-V361 HydrophobicContact CD2-CG1 3.77Å; L355-V361 HydrophobicContact CD2-CG2 3.77Å; N358-V361 WeakPolarHBondContact OD1-CB 3.38Å; N358-V361 WeakPolarHBondContact OD1-CG2 3.47Å; N358-V361 PolarHBondContact OD1-N 3.43Å; V361-V363 VanDerWaalsContact CG1-O 3.32Å; V361-V363 WeakPolarHBondContact CG1-O 3.26Å; V361-T388 CarbonylContact O-C 3.58Å; V361-T388 PolarHBondContact O-OG1 3.23Å; V361-I389 HydrophobicContact CG1-CG1 4.39Å; V361-I389 PolarHBondContact O-N 2.84Å
362	K	97.7	Very high	96.3	Very high	112 Å²	112	41.3 Å²	41.3	49%	0.487	20%	0.204	S	C	.	.			trans	-112.2	-25.8	-179	-69.1	162	-169.3	163.4	0	112.7	T333 V360 T390 S391	T333-K362 PolarHBondContact O-N 3.38Å; V360-K362 PolarHBondContact O-N 3.28Å; K362-T390 PolarHBondContact O-N 3.25Å; K362-T390 PolarHBondContact O-OG1 3.02Å; K362-T390 VanDerWaalsContact O-OG1 3.05Å; K362-S391 PolarHBondContact O-N 2.97Å; K362-S391 VanDerWaalsContact O-N 3.13Å
363	V	98	Very high	96.3	Very high	31 Å²	31	42.6 Å²	42.6	19%	0.188	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.6	-179.1	-173.8	0	0	0	0	108.9	E334 V335 V361 S391	E334-V363 HydrophobicContact CB-CB 4.13Å; E334-V363 HydrophobicContact CG-CB 3.89Å; E334-V363 HydrophobicContact CG-CG2 3.92Å; V335-V363 PolarHBondContact N-O 3.33Å; V361-V363 VanDerWaalsContact CG1-O 3.32Å; V361-V363 WeakPolarHBondContact CG1-O 3.26Å; V363-S391 WeakPolarHBondContact CA-O 3.47Å
364	F	97.8	Very high	96.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.3	169.1	-178.1	-144.3	0	0	0	109.2	V335 F351 T352 L355 L366 I379 M382 I389 S391 L392 N393	V335-F364 HydrophobicContact CB-CD2 3.88Å; V335-F364 HydrophobicContact CB-CE2 4.48Å; V335-F364 HydrophobicContact CG1-CD2 3.72Å; V335-F364 HydrophobicContact CG1-CE2 3.83Å; V335-F364 CarbonylContact O-C 3.36Å; V335-F364 WeakPolarHBondContact O-CA 3.37Å; F351-F364 HydrophobicContact CB-CE2 4.27Å; F351-F364 HydrophobicContact CB-CZ 4.13Å; T352-F364 HydrophobicContact CG2-CE1 3.85Å; T352-F364 HydrophobicContact CG2-CZ 4.21Å; L355-F364 HydrophobicContact CD1-CB 4.23Å; L355-F364 HydrophobicContact CD1-CD1 3.68Å; L355-F364 HydrophobicContact CD1-CD2 3.75Å; L355-F364 HydrophobicContact CD1-CE1 3.85Å; L355-F364 HydrophobicContact CD1-CE2 3.91Å; L355-F364 HydrophobicContact CD1-CG 3.63Å; L355-F364 HydrophobicContact CD1-CZ 3.95Å; F364-L366 HydrophobicContact CD1-CD2 3.84Å; F364-L366 HydrophobicContact CD2-CD2 4.22Å; F364-L366 HydrophobicContact CE1-CD2 3.59Å; F364-L366 HydrophobicContact CE2-CD2 4Å; F364-L366 HydrophobicContact CG-CD2 4.16Å; F364-L366 HydrophobicContact CZ-CD2 3.68Å; F364-I379 HydrophobicContact CE1-CG1 4.45Å; F364-M382 HydrophobicContact CD1-CE 4.05Å; F364-M382 HydrophobicContact CE1-CE 4.34Å; F364-I389 HydrophobicContact CB-CD1 4.35Å; F364-S391 PolarHBondContact N-O 3.44Å; F364-L392 HydrophobicContact CB-CD1 4.08Å; F364-L392 HydrophobicContact CD1-CD1 3.65Å; F364-L392 HydrophobicContact CG-CD1 4.19Å; F364-L392 WeakPolarHBondContact O-CA 3.15Å; F364-N393 PolarHBondContact O-N 2.95Å
365	A	97.6	Very high	96.5	Very high	8 Å²	8	42.8 Å²	42.8	7%	0.066	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120.7	-174.6	0	0	0	0	0	111	V335 V337 N338 N393	V335-A365 PolarHBondContact O-N 2.94Å; V337-A365 WeakPolarHBondContact CG2-O 3.31Å; V337-A365 PolarHBondContact N-O 2.8Å; N338-A365 WeakPolarHBondContact OD1-CB 3.45Å; N338-A365 PolarHBondContact OD1-O 3.05Å; A365-N393 HydrophobicContact CB-CB 4.03Å
366	L	96.4	Very high	96.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.			trans	-136.5	39.7	-179.6	58.9	152.5	0	0	0	110.7	V337 N338 L348 F364 T369 A371 V375 I379 L392 N393 L394 N397	V337-L366 HydrophobicContact CG2-CB 3.71Å; N338-L366 PolarHBondContact OD1-N 3.47Å; L348-L366 HydrophobicContact CD1-CD1 4.27Å; L348-L366 HydrophobicContact CD2-CB 4.01Å; L348-L366 HydrophobicContact CD2-CD1 3.97Å; F364-L366 HydrophobicContact CD1-CD2 3.84Å; F364-L366 HydrophobicContact CD2-CD2 4.22Å; F364-L366 HydrophobicContact CE1-CD2 3.59Å; F364-L366 HydrophobicContact CE2-CD2 4Å; F364-L366 HydrophobicContact CG-CD2 4.16Å; F364-L366 HydrophobicContact CZ-CD2 3.68Å; L366-T369 HydrophobicContact CB-CG2 4.07Å; L366-T369 WeakPolarHBondContact O-CG2 3.41Å; L366-T369 PolarHBondContact O-OG1 2.65Å; L366-A371 HydrophobicContact CD1-CB 4Å; L366-V375 HydrophobicContact CD1-CG1 4.01Å; L366-I379 HydrophobicContact CD1-CD1 4.27Å; L366-L392 HydrophobicContact CD2-CD1 4.3Å; L366-N393 PolarHBondContact N-O 2.86Å; L366-L394 HydrophobicContact CD1-CD2 4.02Å; L366-L394 HydrophobicContact CD2-CD2 3.45Å; L366-L394 VanDerWaalsContact CD2-CD2 3.45Å; L366-L394 HydrophobicContact CG-CD2 3.74Å; L366-N397 PolarHBondContact O-ND2 3.3Å
367	A	96.6	Very high	96.7	Very high	13 Å²	13	44.9 Å²	44.9	11%	0.107	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	139.1	178	0	0	0	0	0	111.2	N338 N339 D395	N338-A367 CarbonylContact C-O 3.44Å; N338-A367 VanDerWaalsContact CA-O 3.24Å; N338-A367 WeakPolarHBondContact CA-O 3.44Å; N338-A367 WeakPolarHBondContact OD1-CB 3.48Å; N338-A367 PolarHBondContact OD1-N 3.03Å; N339-A367 PolarHBondContact N-O 3.38Å; A367-D395 CarbonylContact C-O 3.57Å; A367-D395 WeakPolarHBondContact CA-O 3.39Å; A367-D395 HydrophobicContact CB-CB 4.05Å; A367-D395 WeakPolarHBondContact CB-O 3.29Å
368	N	95.8	Very high	96.9	Very high	68 Å²	68	38.4 Å²	38.4	36%	0.364	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	52.7	-176.9	-169.7	34.8	0	0	0	113	N339 D395 S396	N339-N368 WeakPolarHBondContact CA-O 3.43Å; N339-N368 PolarHBondContact N-O 3.46Å; N339-N368 WeakPolarHBondContact OD1-CB 3.49Å; N339-N368 PolarHBondContact OD1-ND2 3.41Å; N368-D395 PolarHBondContact N-O 2.95Å; N368-S396 WeakPolarHBondContact CA-O 3.49Å
369	T	95.6	Very high	97.1	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	19%	0.192	C	C	.	.	S	Bend	trans	-119.1	8.5	176.9	58	0	0	0	0	113	V337 I343 L366 A371 N397	V337-T369 HydrophobicContact CG2-CG2 4.27Å; V337-T369 VanDerWaalsContact O-CG2 3.23Å; V337-T369 WeakPolarHBondContact O-CG2 3.31Å; I343-T369 HydrophobicContact CG2-CG2 3.93Å; L366-T369 HydrophobicContact CB-CG2 4.07Å; L366-T369 WeakPolarHBondContact O-CG2 3.41Å; L366-T369 PolarHBondContact O-OG1 2.65Å; T369-A371 PolarHBondContact O-N 2.88Å; T369-N397 PolarHBondContact N-OD1 2.87Å; T369-N397 PolarHBondContact OG1-OD1 3.06Å
370	R	95.3	Very high	97.2	Very high	138 Å²	138	33.9 Å²	33.9	52%	0.521	17%	0.165	S	C	.	.			trans	63.7	13.6	-177.8	-48	177.1	-170.8	-165.7	3.1	114.2	D341 N397 H398	D341-R370 IonicContact OD1-CZ 2.66Å; D341-R370 IonicContact OD1-NE 3.14Å; D341-R370 IonicContact OD1-NH2 2.67Å; D341-R370 PolarHBondContact OD1-NH2 2.9Å; R370-N397 PolarHBondContact N-OD1 3.4Å; R370-H398 PolarHBondContact O-ND1 2.85Å
371	A	96.4	Very high	97.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.			trans	-53.3	141.1	179.3	0	0	0	0	0	112.4	L348 L366 T369 V375 N397 H398 I399	L348-A371 HydrophobicContact CD1-CB 3.8Å; L366-A371 HydrophobicContact CD1-CB 4Å; T369-A371 PolarHBondContact O-N 2.88Å; A371-V375 HydrophobicContact CB-CB 4.18Å; A371-V375 HydrophobicContact CB-CG1 4.14Å; A371-V375 HydrophobicContact CB-CG2 4.33Å; A371-N397 HydrophobicContact CB-CB 4.23Å; A371-N397 PolarHBondContact N-OD1 3.15Å; A371-H398 CarbonylContact O-C 3.58Å; A371-H398 VanDerWaalsContact O-CA 3.31Å; A371-H398 WeakPolarHBondContact O-CA 3.44Å; A371-H398 WeakPolarHBondContact O-CB 3.28Å; A371-H398 PolarHBondContact O-N 2.87Å; A371-I399 PolarHBondContact O-N 2.86Å
372	D	96.2	Very high	97.2	Very high	50 Å²	50	37.2 Å²	37.2	27%	0.267	18%	0.181	S	C	.	.			trans	-116.3	-171.5	-170.7	64.7	12.9	0	0	0	113.2	N345 H374 V375 A376	N345-D372 PolarHBondContact ND2-OD2 2.91Å; D372-H374 PolarHBondContact O-N 2.69Å; D372-H374 WeakPolarHBondContact OD1-CA 3.31Å; D372-H374 VanDerWaalsContact OD1-CB 3.28Å; D372-H374 WeakPolarHBondContact OD1-CB 3.46Å; D372-H374 PolarHBondContact OD1-N 2.83Å; D372-V375 PolarHBondContact O-N 2.94Å; D372-V375 PolarHBondContact OD1-N 3.22Å; D372-A376 WeakPolarHBondContact O-CB 3.47Å; D372-A376 PolarHBondContact O-N 3Å
373	D	97	Very high	97.2	Very high	29 Å²	29	31.9 Å²	31.9	16%	0.155	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-29.1	173.5	-83.6	-16.8	0	0	0	112.9	A376 F377 T400 G403	D373-A376 PolarHBondContact O-N 3Å; D373-F377 HydrophobicContact CB-CE2 4.1Å; D373-F377 WeakPolarHBondContact O-CD2 3.42Å; D373-F377 WeakPolarHBondContact O-CG 3.35Å; D373-F377 PolarHBondContact O-N 3.01Å; D373-T400 VanDerWaalsContact CG-OG1 3.29Å; D373-T400 WeakPolarHBondContact OD1-CA 3.44Å; D373-T400 PolarHBondContact OD1-N 3.11Å; D373-T400 PolarHBondContact OD1-OG1 2.94Å; D373-T400 VanDerWaalsContact OD1-OG1 3.12Å; D373-T400 WeakPolarHBondContact OD2-CG2 3.49Å; D373-T400 PolarHBondContact OD2-OG1 3.04Å; D373-G403 WeakPolarHBondContact OD1-CA 3.35Å; D373-G403 PolarHBondContact OD1-N 3.4Å
374	H	97.5	Very high	97.1	Very high	115 Å²	115	34.9 Å²	34.9	53%	0.532	17%	0.169	S	C	.	.	H	α-helix	trans	-70.8	-46.8	179.4	178.6	59.4	0	0	0	111.3	D372 A376 F377 A378	D372-H374 PolarHBondContact O-N 2.69Å; D372-H374 WeakPolarHBondContact OD1-CA 3.31Å; D372-H374 VanDerWaalsContact OD1-CB 3.28Å; D372-H374 WeakPolarHBondContact OD1-CB 3.46Å; D372-H374 PolarHBondContact OD1-N 2.83Å; H374-A376 VanDerWaalsContact C-N 3.26Å; H374-A376 PolarHBondContact O-N 3.1Å; H374-F377 PolarHBondContact O-N 3.36Å; H374-F377 VanDerWaalsContact O-N 3.16Å; H374-A378 PolarHBondContact O-N 3.33Å
375	V	97.6	Very high	97	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.2	-41.6	170.5	-178.5	0	0	0	0	110.3	N345 L348 V349 L366 A371 D372 F377 A378 I379	N345-V375 HydrophobicContact CB-CG2 3.81Å; L348-V375 HydrophobicContact CB-CG1 3.93Å; L348-V375 HydrophobicContact CB-CG2 4Å; L348-V375 HydrophobicContact CD1-CG1 4.37Å; L348-V375 HydrophobicContact CD1-CG2 4.19Å; V349-V375 HydrophobicContact CG2-CG2 4.4Å; L366-V375 HydrophobicContact CD1-CG1 4.01Å; A371-V375 HydrophobicContact CB-CB 4.18Å; A371-V375 HydrophobicContact CB-CG1 4.14Å; A371-V375 HydrophobicContact CB-CG2 4.33Å; D372-V375 PolarHBondContact O-N 2.94Å; D372-V375 PolarHBondContact OD1-N 3.22Å; V375-F377 PolarHBondContact O-N 3.17Å; V375-A378 PolarHBondContact O-N 3Å; V375-I379 HydrophobicContact CG1-CD1 3.97Å; V375-I379 HydrophobicContact CG1-CG1 4.47Å; V375-I379 VanDerWaalsContact O-CG1 3.29Å; V375-I379 WeakPolarHBondContact O-CG1 3.5Å; V375-I379 PolarHBondContact O-N 3.26Å
376	A	97.9	Very high	96.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.1	-33.4	176.9	0	0	0	0	0	113.9	D372 D373 H374 A380 I399 I407	D372-A376 WeakPolarHBondContact O-CB 3.47Å; D372-A376 PolarHBondContact O-N 3Å; D373-A376 PolarHBondContact O-N 3Å; H374-A376 VanDerWaalsContact C-N 3.26Å; H374-A376 PolarHBondContact O-N 3.1Å; A376-A380 WeakPolarHBondContact O-CB 3.21Å; A376-A380 PolarHBondContact O-N 2.92Å; A376-I399 HydrophobicContact CB-CD1 4.22Å; A376-I399 HydrophobicContact CB-CG1 4.38Å; A376-I399 HydrophobicContact CB-CG2 3.54Å; A376-I407 HydrophobicContact CB-CD1 4.1Å
377	F	98.4	Very high	96.9	Very high	97 Å²	97	40.8 Å²	40.8	43%	0.425	20%	0.2	S	C	.	.	H	α-helix	trans	-68.1	-40.4	171.8	-70.7	-56.1	0	0	0	112	D373 H374 V375 A380 I381 K402 A406	D373-F377 HydrophobicContact CB-CE2 4.1Å; D373-F377 WeakPolarHBondContact O-CD2 3.42Å; D373-F377 WeakPolarHBondContact O-CG 3.35Å; D373-F377 PolarHBondContact O-N 3.01Å; H374-F377 PolarHBondContact O-N 3.36Å; H374-F377 VanDerWaalsContact O-N 3.16Å; V375-F377 PolarHBondContact O-N 3.17Å; F377-A380 CarbonylContact O-C 3.54Å; F377-A380 WeakPolarHBondContact O-CB 3.31Å; F377-A380 PolarHBondContact O-N 3.38Å; F377-I381 PolarHBondContact O-N 2.93Å; F377-I381 VanDerWaalsContact O-N 3.1Å; F377-K402 HydrophobicContact CZ-CB 4.47Å; F377-A406 HydrophobicContact CD1-CB 3.51Å; F377-A406 HydrophobicContact CE1-CB 3.68Å
378	A	98.1	Very high	96.9	Very high	17 Å²	17	41.8 Å²	41.8	14%	0.14	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-44.2	176	0	0	0	0	0	111.6	V349 T352 H374 V375 A380 I381 M382	V349-A378 HydrophobicContact CG1-CB 4.47Å; V349-A378 HydrophobicContact CG2-CB 4.13Å; T352-A378 VanDerWaalsContact OG1-CB 3.29Å; T352-A378 WeakPolarHBondContact OG1-CB 3.42Å; H374-A378 PolarHBondContact O-N 3.33Å; V375-A378 PolarHBondContact O-N 3Å; A378-A380 VanDerWaalsContact C-N 3.28Å; A378-A380 PolarHBondContact O-N 3.35Å; A378-I381 PolarHBondContact O-N 3.42Å; A378-M382 PolarHBondContact O-N 2.97Å
379	I	98.1	Very high	97	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-55	-42.3	169.6	-69.6	169.5	0	0	0	111.5	T352 F364 L366 V375 I381 M382 L383 L392 L394 I407	T352-I379 HydrophobicContact CG2-CD1 4.49Å; T352-I379 HydrophobicContact CG2-CG1 3.51Å; F364-I379 HydrophobicContact CE1-CG1 4.45Å; L366-I379 HydrophobicContact CD1-CD1 4.27Å; V375-I379 HydrophobicContact CG1-CD1 3.97Å; V375-I379 HydrophobicContact CG1-CG1 4.47Å; V375-I379 VanDerWaalsContact O-CG1 3.29Å; V375-I379 WeakPolarHBondContact O-CG1 3.5Å; V375-I379 PolarHBondContact O-N 3.26Å; I379-I381 VanDerWaalsContact C-N 3.25Å; I379-I381 PolarHBondContact O-N 3.02Å; I379-M382 HydrophobicContact CG2-CE 4.37Å; I379-M382 PolarHBondContact O-N 3.01Å; I379-L383 HydrophobicContact CG2-CD1 3.82Å; I379-L383 HydrophobicContact CG2-CG 4.23Å; I379-L383 WeakPolarHBondContact O-CB 3.4Å; I379-L383 VanDerWaalsContact O-CG 3.31Å; I379-L383 WeakPolarHBondContact O-CG 3.45Å; I379-L383 PolarHBondContact O-N 3.28Å; I379-L392 HydrophobicContact CG2-CD2 3.65Å; I379-L394 HydrophobicContact CD1-CD1 4.41Å; I379-L394 HydrophobicContact CD1-CD2 3.63Å; I379-I407 HydrophobicContact CG2-CD1 4.07Å; I379-I407 HydrophobicContact CG2-CG1 4.08Å
380	A	98	Very high	97.1	Very high	6 Å²	6	41 Å²	41	5%	0.05	20%	0.202	C	C	.	.	H	α-helix	trans	-71.8	-14	178.8	0	0	0	0	0	114.5	A376 F377 A378 K384 A406 I407 A410	A376-A380 WeakPolarHBondContact O-CB 3.21Å; A376-A380 PolarHBondContact O-N 2.92Å; F377-A380 CarbonylContact O-C 3.54Å; F377-A380 WeakPolarHBondContact O-CB 3.31Å; F377-A380 PolarHBondContact O-N 3.38Å; A378-A380 VanDerWaalsContact C-N 3.28Å; A378-A380 PolarHBondContact O-N 3.35Å; A380-K384 VanDerWaalsContact O-CE 3.31Å; A380-K384 WeakPolarHBondContact O-CE 3.36Å; A380-A406 VanDerWaalsContact CB-C 3.47Å; A380-A406 HydrophobicContact CB-CB 3.75Å; A380-A406 WeakPolarHBondContact CB-O 3.37Å; A380-I407 HydrophobicContact CB-CG1 4.19Å; A380-A410 HydrophobicContact CB-CB 4.23Å; A380-A410 WeakPolarHBondContact O-CB 3.39Å
381	I	97.3	Very high	97.3	Very high	93 Å²	93	35.3 Å²	35.3	48%	0.477	18%	0.184	S	C	.	.	H	α-helix	trans	-84.5	-55.6	167.1	-66	165.5	0	0	0	108.5	F377 A378 I379 L383 K384	F377-I381 PolarHBondContact O-N 2.93Å; F377-I381 VanDerWaalsContact O-N 3.1Å; A378-I381 PolarHBondContact O-N 3.42Å; I379-I381 VanDerWaalsContact C-N 3.25Å; I379-I381 PolarHBondContact O-N 3.02Å; I381-L383 VanDerWaalsContact C-N 3.29Å; I381-L383 PolarHBondContact O-N 2.9Å; I381-K384 WeakPolarHBondContact O-CB 3.16Å; I381-K384 PolarHBondContact O-N 3.02Å
382	M	97.5	Very high	97.4	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-49	-45.4	179	171.9	-84.7	-79.1	0	0	112.9	T352 L355 F364 A378 I379 K384 A385 N386 I389	T352-M382 WeakPolarHBondContact O-CG 3.2Å; L355-M382 HydrophobicContact CB-CG 3.99Å; L355-M382 HydrophobicContact CB-SD 4.48Å; F364-M382 HydrophobicContact CD1-CE 4.05Å; F364-M382 HydrophobicContact CE1-CE 4.34Å; A378-M382 PolarHBondContact O-N 2.97Å; I379-M382 HydrophobicContact CG2-CE 4.37Å; I379-M382 PolarHBondContact O-N 3.01Å; M382-K384 PolarHBondContact O-N 3.46Å; M382-K384 VanDerWaalsContact O-N 3.14Å; M382-A385 PolarHBondContact O-N 2.84Å; M382-N386 HydrophobicContact CG-CB 4.4Å; M382-N386 VanDerWaalsContact O-CB 3.31Å; M382-N386 WeakPolarHBondContact O-CB 3.27Å; M382-N386 PolarHBondContact O-N 3.39Å; M382-N386 HydrophobicContact SD-CB 3.98Å; M382-I389 HydrophobicContact CE-CD1 3.93Å; M382-I389 HydrophobicContact SD-CD1 3.72Å
383	L	97.6	Very high	97.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-20.6	179.4	-75.9	172	0	0	0	114.3	I379 I381 L392 I407 A410 L411 N414 L417	I379-L383 HydrophobicContact CG2-CD1 3.82Å; I379-L383 HydrophobicContact CG2-CG 4.23Å; I379-L383 WeakPolarHBondContact O-CB 3.4Å; I379-L383 VanDerWaalsContact O-CG 3.31Å; I379-L383 WeakPolarHBondContact O-CG 3.45Å; I379-L383 PolarHBondContact O-N 3.28Å; I381-L383 VanDerWaalsContact C-N 3.29Å; I381-L383 PolarHBondContact O-N 2.9Å; L383-L392 HydrophobicContact CD1-CD2 3.95Å; L383-L392 HydrophobicContact CD2-CD2 4.4Å; L383-I407 HydrophobicContact CD1-CG2 3.9Å; L383-A410 HydrophobicContact CB-CB 4.11Å; L383-L411 HydrophobicContact CD1-CD2 4.34Å; L383-N414 WeakPolarHBondContact O-CB 3.43Å; L383-N414 PolarHBondContact O-ND2 3.13Å; L383-L417 HydrophobicContact CD2-CD1 4.41Å; L383-L417 HydrophobicContact CD2-CD2 4.35Å
384	K	96.1	Very high	97.5	Very high	94 Å²	94	32.6 Å²	32.6	41%	0.409	17%	0.169	S	C	.	.	H	α-helix	trans	-77.8	-38.2	176.6	-63.6	172.2	-177.6	166.4	0	111.7	A380 I381 M382 K387 A410	A380-K384 VanDerWaalsContact O-CE 3.31Å; A380-K384 WeakPolarHBondContact O-CE 3.36Å; I381-K384 WeakPolarHBondContact O-CB 3.16Å; I381-K384 PolarHBondContact O-N 3.02Å; M382-K384 PolarHBondContact O-N 3.46Å; M382-K384 VanDerWaalsContact O-N 3.14Å; K384-K387 WeakPolarHBondContact O-CE 3.5Å; K384-K387 PolarHBondContact O-NZ 2.85Å; K384-A410 HydrophobicContact CG-CB 3.99Å
385	A	95.6	Very high	97.4	Very high	38 Å²	38	28.5 Å²	28.5	31%	0.314	15%	0.151	S	C	.	.	H	α-helix	trans	-82.9	-52	177.5	0	0	0	0	0	111.6	E356 M382 K387	E356-A385 HydrophobicContact CG-CB 3.47Å; E356-A385 VanDerWaalsContact CG-CB 3.47Å; M382-A385 PolarHBondContact O-N 2.84Å; A385-K387 VanDerWaalsContact O-CE 3.29Å; A385-K387 WeakPolarHBondContact O-CE 3.19Å
386	N	96.4	Very high	97.4	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	17%	0.166	C	C	.	.			trans	-60.2	139.7	-175.7	-173.5	-74.9	0	0	0	111.9	L355 E356 N358 M382 T388 I389 N414	L355-N386 PolarHBondContact O-ND2 2.92Å; E356-N386 PolarHBondContact O-N 3.23Å; N358-N386 PolarHBondContact O-ND2 2.85Å; N358-N386 VanDerWaalsContact O-ND2 3.1Å; M382-N386 HydrophobicContact CG-CB 4.4Å; M382-N386 VanDerWaalsContact O-CB 3.31Å; M382-N386 WeakPolarHBondContact O-CB 3.27Å; M382-N386 PolarHBondContact O-N 3.39Å; M382-N386 HydrophobicContact SD-CB 3.98Å; N386-T388 PolarHBondContact ND2-OG1 2.71Å; N386-T388 PolarHBondContact OD1-N 3.43Å; N386-T388 PolarHBondContact OD1-OG1 3.37Å; N386-I389 PolarHBondContact OD1-N 3.11Å; N386-N414 PolarHBondContact O-ND2 3.21Å
387	K	95.8	Very high	97.3	Very high	91 Å²	91	30.6 Å²	30.6	40%	0.396	17%	0.166	S	C	.	.			trans	-129.5	18.1	179.5	-55.8	-60.2	158.8	-145.5	0	113.7	K384 A385 Q413 T416	K384-K387 WeakPolarHBondContact O-CE 3.5Å; K384-K387 PolarHBondContact O-NZ 2.85Å; A385-K387 VanDerWaalsContact O-CE 3.29Å; A385-K387 WeakPolarHBondContact O-CE 3.19Å; K387-Q413 PolarHBondContact NZ-O 3.19Å; K387-T416 HydrophobicContact CB-CG2 3.89Å; K387-T416 HydrophobicContact CD-CG2 3.99Å; K387-T416 WeakPolarHBondContact O-CG2 3.45Å
388	T	97.1	Very high	97.2	Very high	34 Å²	34	29.3 Å²	29.3	21%	0.209	16%	0.161	C	C	.	.	S	Bend	trans	-124.2	-27.9	-174.2	65.4	0	0	0	0	113.7	N358 V361 N386 T390	N358-T388 PolarHBondContact O-OG1 2.9Å; V361-T388 CarbonylContact O-C 3.58Å; V361-T388 PolarHBondContact O-OG1 3.23Å; N386-T388 PolarHBondContact ND2-OG1 2.71Å; N386-T388 PolarHBondContact OD1-N 3.43Å; N386-T388 PolarHBondContact OD1-OG1 3.37Å; T388-T390 PolarHBondContact O-N 2.94Å
389	I	97.8	Very high	97.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.			trans	-67.8	124.1	173.8	-61.4	171.9	0	0	0	108.7	L355 V361 F364 M382 N386 S391 T416 L417	L355-I389 HydrophobicContact CB-CD1 4.36Å; L355-I389 HydrophobicContact CD1-CD1 4.27Å; L355-I389 HydrophobicContact CD2-CD1 4.34Å; V361-I389 HydrophobicContact CG1-CG1 4.39Å; V361-I389 PolarHBondContact O-N 2.84Å; F364-I389 HydrophobicContact CB-CD1 4.35Å; M382-I389 HydrophobicContact CE-CD1 3.93Å; M382-I389 HydrophobicContact SD-CD1 3.72Å; N386-I389 PolarHBondContact OD1-N 3.11Å; I389-S391 WeakPolarHBondContact CG2-O 3.3Å; I389-T416 CarbonylContact O-C 3.38Å; I389-T416 PolarHBondContact O-OG1 3.38Å; I389-L417 HydrophobicContact CG2-CD1 3.86Å
390	T	97.9	Very high	97.1	Very high	54 Å²	54	30.4 Å²	30.4	33%	0.331	17%	0.166	S	C	.	.			trans	-111.3	-21.8	-178.9	60.4	0	0	0	0	112.5	K362 T388 T418 E419	K362-T390 PolarHBondContact O-N 3.25Å; K362-T390 PolarHBondContact O-OG1 3.02Å; K362-T390 VanDerWaalsContact O-OG1 3.05Å; T388-T390 PolarHBondContact O-N 2.94Å; T390-T418 WeakPolarHBondContact O-CA 3.46Å; T390-T418 PolarHBondContact O-N 2.64Å; T390-T418 PolarHBondContact O-OG1 3.23Å; T390-E419 PolarHBondContact O-N 2.81Å
391	S	98.3	Very high	97	Very high	18 Å²	18	30.6 Å²	30.6	13%	0.126	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129	-180	-175	0	0	0	0	111.2	K362 V363 F364 I389 E419	K362-S391 PolarHBondContact O-N 2.97Å; K362-S391 VanDerWaalsContact O-N 3.13Å; V363-S391 WeakPolarHBondContact CA-O 3.47Å; F364-S391 PolarHBondContact N-O 3.44Å; I389-S391 WeakPolarHBondContact CG2-O 3.3Å; S391-E419 WeakPolarHBondContact CA-O 3.46Å
392	L	98.4	Very high	96.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	123	179.9	178.2	59.5	0	0	0	110.5	F364 L366 I379 L383 L394 L417 E419 L420 R421	F364-L392 HydrophobicContact CB-CD1 4.08Å; F364-L392 HydrophobicContact CD1-CD1 3.65Å; F364-L392 HydrophobicContact CG-CD1 4.19Å; F364-L392 WeakPolarHBondContact O-CA 3.15Å; L366-L392 HydrophobicContact CD2-CD1 4.3Å; I379-L392 HydrophobicContact CG2-CD2 3.65Å; L383-L392 HydrophobicContact CD1-CD2 3.95Å; L383-L392 HydrophobicContact CD2-CD2 4.4Å; L392-L394 HydrophobicContact CD1-CD2 3.93Å; L392-L394 HydrophobicContact CD1-CG 4.47Å; L392-L394 HydrophobicContact CD2-CD1 4.44Å; L392-L394 HydrophobicContact CG-CD1 4.5Å; L392-L394 HydrophobicContact CG-CD2 4.2Å; L392-L394 HydrophobicContact CG-CG 4.21Å; L392-L417 HydrophobicContact CB-CD1 3.84Å; L392-L417 HydrophobicContact CB-CD2 4.28Å; L392-E419 PolarHBondContact N-O 2.76Å; L392-L420 HydrophobicContact CB-CD1 4.19Å; L392-L420 HydrophobicContact CD2-CD1 3.9Å; L392-L420 HydrophobicContact CG-CD1 4.02Å; L392-L420 CarbonylContact O-C 3.53Å; L392-L420 WeakPolarHBondContact O-CA 3.41Å; L392-R421 PolarHBondContact O-N 3.21Å
393	N	98.2	Very high	96.9	Very high	22 Å²	22	33.2 Å²	33.2	12%	0.118	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.5	-179.8	-173.7	6.1	0	0	0	112.6	F364 A365 L366 D395	F364-N393 PolarHBondContact O-N 2.95Å; A365-N393 HydrophobicContact CB-CB 4.03Å; L366-N393 PolarHBondContact N-O 2.86Å; N393-D395 WeakPolarHBondContact OD1-CB 3.42Å; N393-D395 PolarHBondContact OD1-N 2.92Å; N393-D395 PolarHBondContact OD1-OD2 2.96Å
394	L	97.4	Very high	96.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.			trans	-122.3	15.8	-179.4	-47.5	176.8	0	0	0	112.4	L366 I379 L392 N397 I399 I407 L420 R421 F422 Q425	L366-L394 HydrophobicContact CD1-CD2 4.02Å; L366-L394 HydrophobicContact CD2-CD2 3.45Å; L366-L394 VanDerWaalsContact CD2-CD2 3.45Å; L366-L394 HydrophobicContact CG-CD2 3.74Å; I379-L394 HydrophobicContact CD1-CD1 4.41Å; I379-L394 HydrophobicContact CD1-CD2 3.63Å; L392-L394 HydrophobicContact CD1-CD2 3.93Å; L392-L394 HydrophobicContact CD1-CG 4.47Å; L392-L394 HydrophobicContact CD2-CD1 4.44Å; L392-L394 HydrophobicContact CG-CD1 4.5Å; L392-L394 HydrophobicContact CG-CD2 4.2Å; L392-L394 HydrophobicContact CG-CG 4.21Å; L394-N397 VanDerWaalsContact C-ND2 3.34Å; L394-N397 PolarHBondContact O-ND2 3.47Å; L394-I399 HydrophobicContact CB-CD1 3.93Å; L394-I399 HydrophobicContact CD1-CD1 3.94Å; L394-I399 HydrophobicContact CG-CD1 4.39Å; L394-I407 HydrophobicContact CD1-CD1 3.51Å; L394-L420 HydrophobicContact CD1-CD1 4.3Å; L394-R421 WeakPolarHBondContact CA-O 3.43Å; L394-R421 WeakPolarHBondContact CB-O 3.38Å; L394-R421 PolarHBondContact N-O 2.98Å; L394-F422 HydrophobicContact CB-CB 4.16Å; L394-Q425 PolarHBondContact O-NE2 3.34Å
395	D	96.8	Very high	97	Very high	30 Å²	30	29.8 Å²	29.8	16%	0.16	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	147.8	-176.4	-66.6	-22.1	0	0	0	112.7	A367 N368 N393 N397 R421 F422 H423	A367-D395 CarbonylContact C-O 3.57Å; A367-D395 WeakPolarHBondContact CA-O 3.39Å; A367-D395 HydrophobicContact CB-CB 4.05Å; A367-D395 WeakPolarHBondContact CB-O 3.29Å; N368-D395 PolarHBondContact N-O 2.95Å; N393-D395 WeakPolarHBondContact OD1-CB 3.42Å; N393-D395 PolarHBondContact OD1-N 2.92Å; N393-D395 PolarHBondContact OD1-OD2 2.96Å; D395-N397 PolarHBondContact O-N 3.02Å; D395-N397 PolarHBondContact O-ND2 3.21Å; D395-R421 VanDerWaalsContact OD1-C 3.27Å; D395-R421 VanDerWaalsContact OD1-CB 3.28Å; D395-R421 WeakPolarHBondContact OD1-CB 3.47Å; D395-F422 WeakPolarHBondContact OD1-CA 3.37Å; D395-F422 PolarHBondContact OD1-N 2.77Å; D395-H423 CarbonylContact C-O 3.44Å; D395-H423 WeakPolarHBondContact CA-O 3.26Å; D395-H423 IonicContact OD1-CD2 3.62Å; D395-H423 PolarHBondContact OD1-N 2.91Å
396	S	96.1	Very high	97.1	Very high	43 Å²	43	28.8 Å²	28.8	30%	0.301	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	43.4	176.5	-60.5	0	0	0	0	115.4	N368 H423 N424	N368-S396 WeakPolarHBondContact CA-O 3.49Å; S396-H423 PolarHBondContact N-O 3.36Å; S396-N424 WeakPolarHBondContact CA-O 3.46Å; S396-N424 PolarHBondContact OG-ND2 3.15Å
397	N	96.9	Very high	97.2	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.153	C	C	.	.	S	Bend	trans	-116.4	-172.8	179.2	-78.4	-52.8	0	0	0	113.2	L366 T369 R370 A371 L394 D395 I399 Q425 R426	L366-N397 PolarHBondContact O-ND2 3.3Å; T369-N397 PolarHBondContact N-OD1 2.87Å; T369-N397 PolarHBondContact OG1-OD1 3.06Å; R370-N397 PolarHBondContact N-OD1 3.4Å; A371-N397 HydrophobicContact CB-CB 4.23Å; A371-N397 PolarHBondContact N-OD1 3.15Å; L394-N397 VanDerWaalsContact C-ND2 3.34Å; L394-N397 PolarHBondContact O-ND2 3.47Å; D395-N397 PolarHBondContact O-N 3.02Å; D395-N397 PolarHBondContact O-ND2 3.21Å; N397-I399 HydrophobicContact CB-CD1 4.38Å; N397-I399 HydrophobicContact CB-CG1 4.14Å; N397-Q425 CarbonylContact O-C 3.59Å; N397-Q425 VanDerWaalsContact O-CA 3.31Å; N397-Q425 WeakPolarHBondContact O-CA 3.44Å; N397-Q425 PolarHBondContact O-OE1 2.94Å; N397-R426 PolarHBondContact O-N 2.89Å
398	H	96.4	Very high	97.3	Very high	70 Å²	70	24.4 Å²	24.4	32%	0.324	14%	0.135	S	C	.	.			trans	-102	17.6	-177.7	-60.9	161.5	0	0	0	113.1	R370 A371 R426	R370-H398 PolarHBondContact O-ND1 2.85Å; A371-H398 CarbonylContact O-C 3.58Å; A371-H398 VanDerWaalsContact O-CA 3.31Å; A371-H398 WeakPolarHBondContact O-CA 3.44Å; A371-H398 WeakPolarHBondContact O-CB 3.28Å; A371-H398 PolarHBondContact O-N 2.87Å; H398-R426 VanDerWaalsContact CD2-CD 3.48Å; H398-R426 WeakPolarHBondContact CD2-CD 3.37Å
399	I	96.8	Very high	97.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.			trans	-73.8	134.7	-175.9	-47.6	174.1	0	0	0	109.6	A371 A376 L394 N397 I404 Q425	A371-I399 PolarHBondContact O-N 2.86Å; A376-I399 HydrophobicContact CB-CD1 4.22Å; A376-I399 HydrophobicContact CB-CG1 4.38Å; A376-I399 HydrophobicContact CB-CG2 3.54Å; L394-I399 HydrophobicContact CB-CD1 3.93Å; L394-I399 HydrophobicContact CD1-CD1 3.94Å; L394-I399 HydrophobicContact CG-CD1 4.39Å; N397-I399 HydrophobicContact CB-CD1 4.38Å; N397-I399 HydrophobicContact CB-CG1 4.14Å; I399-I404 HydrophobicContact CB-CD1 4.28Å; I399-I404 HydrophobicContact CG2-CD1 3.78Å; I399-I404 HydrophobicContact CG2-CG1 3.97Å; I399-Q425 VanDerWaalsContact N-OE1 3.14Å
400	T	96.3	Very high	97.3	Very high	40 Å²	40	28.5 Å²	28.5	25%	0.245	15%	0.146	C	C	.	.			trans	-95.9	174.8	177.5	87.8	0	0	0	0	111.2	D373 K402 G403 I404	D373-T400 VanDerWaalsContact CG-OG1 3.29Å; D373-T400 WeakPolarHBondContact OD1-CA 3.44Å; D373-T400 PolarHBondContact OD1-N 3.11Å; D373-T400 PolarHBondContact OD1-OG1 2.94Å; D373-T400 VanDerWaalsContact OD1-OG1 3.12Å; D373-T400 WeakPolarHBondContact OD2-CG2 3.49Å; D373-T400 PolarHBondContact OD2-OG1 3.04Å; T400-K402 PolarHBondContact O-N 2.87Å; T400-K402 PolarHBondContact OG1-N 2.81Å; T400-K402 VanDerWaalsContact OG1-N 3.09Å; T400-G403 PolarHBondContact O-N 3.4Å; T400-I404 WeakPolarHBondContact O-CG1 3.38Å; T400-I404 PolarHBondContact O-N 3.18Å; T400-I404 VanDerWaalsContact O-N 3.11Å
401	G	96.2	Very high	97.3	Very high	10 Å²	10	26 Å²	26	10%	0.103	13%	0.131	C	C	.	.	H	α-helix	trans	-54.9	-19.3	171.3	0	0	0	0	0	114.4	L405	G401-L405 WeakPolarHBondContact O-CB 3.41Å; G401-L405 WeakPolarHBondContact O-CD1 3.29Å; G401-L405 WeakPolarHBondContact O-CG 3.32Å; G401-L405 PolarHBondContact O-N 3.36Å; G401-L405 VanDerWaalsContact O-N 3.1Å
402	K	96.3	Very high	97.2	Very high	150 Å²	150	28.5 Å²	28.5	65%	0.652	14%	0.143	S	C	*	.	H	α-helix	trans	-70.7	-53.9	174.1	-62.9	176.6	-178.1	173.9	0	111.8	F377 T400 L405 A406	F377-K402 HydrophobicContact CZ-CB 4.47Å; T400-K402 PolarHBondContact O-N 2.87Å; T400-K402 PolarHBondContact OG1-N 2.81Å; T400-K402 VanDerWaalsContact OG1-N 3.09Å; K402-L405 PolarHBondContact O-N 3.07Å; K402-A406 PolarHBondContact O-N 3.48Å
403	G	97.2	Very high	97	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-43.2	177.4	0	0	0	0	0	112.1	D373 T400 L405 A406 I407	D373-G403 WeakPolarHBondContact OD1-CA 3.35Å; D373-G403 PolarHBondContact OD1-N 3.4Å; T400-G403 PolarHBondContact O-N 3.4Å; G403-L405 PolarHBondContact O-N 3.3Å; G403-A406 WeakPolarHBondContact O-CB 3.37Å; G403-A406 PolarHBondContact O-N 2.73Å; G403-A406 VanDerWaalsContact O-N 3.12Å; G403-I407 PolarHBondContact O-N 2.88Å; G403-I407 VanDerWaalsContact O-N 3.11Å
404	I	97.8	Very high	96.8	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-43.6	175.5	-61.4	-53.5	0	0	0	111.7	I399 T400 A406 I407 F408 F422 I437	I399-I404 HydrophobicContact CB-CD1 4.28Å; I399-I404 HydrophobicContact CG2-CD1 3.78Å; I399-I404 HydrophobicContact CG2-CG1 3.97Å; T400-I404 WeakPolarHBondContact O-CG1 3.38Å; T400-I404 PolarHBondContact O-N 3.18Å; T400-I404 VanDerWaalsContact O-N 3.11Å; I404-A406 VanDerWaalsContact C-N 3.31Å; I404-A406 PolarHBondContact O-N 3.11Å; I404-I407 PolarHBondContact O-N 3.02Å; I404-F408 HydrophobicContact CG2-CD2 3.83Å; I404-F408 HydrophobicContact CG2-CE2 3.8Å; I404-F408 WeakPolarHBondContact O-CD2 3.5Å; I404-F408 PolarHBondContact O-N 2.84Å; I404-F422 HydrophobicContact CD1-CB 3.81Å; I404-F422 HydrophobicContact CD1-CD1 3.97Å; I404-F422 HydrophobicContact CD1-CD2 3.65Å; I404-F422 HydrophobicContact CD1-CE1 4.46Å; I404-F422 HydrophobicContact CD1-CE2 4.2Å; I404-F422 HydrophobicContact CD1-CG 3.55Å; I404-F422 HydrophobicContact CG1-CD2 3.97Å; I404-F422 HydrophobicContact CG1-CE2 4.17Å; I404-F422 HydrophobicContact CG1-CG 4.38Å; I404-F422 HydrophobicContact CG2-CD2 4.23Å; I404-F422 HydrophobicContact CG2-CE1 3.98Å; I404-F422 HydrophobicContact CG2-CE2 3.65Å; I404-F422 HydrophobicContact CG2-CZ 3.53Å; I404-I437 HydrophobicContact CG2-CD1 3.79Å; I404-I437 HydrophobicContact CG2-CG1 4.49Å
405	L	97.8	Very high	96.7	Very high	21 Å²	21	38.7 Å²	38.7	11%	0.11	19%	0.193	C	C	.	.	H	α-helix	trans	-69.2	-25.7	176.2	-73.9	173.2	0	0	0	113.9	G401 K402 G403 R409 T433 E436 I437 L440	G401-L405 WeakPolarHBondContact O-CB 3.41Å; G401-L405 WeakPolarHBondContact O-CD1 3.29Å; G401-L405 WeakPolarHBondContact O-CG 3.32Å; G401-L405 PolarHBondContact O-N 3.36Å; G401-L405 VanDerWaalsContact O-N 3.1Å; K402-L405 PolarHBondContact O-N 3.07Å; G403-L405 PolarHBondContact O-N 3.3Å; L405-R409 WeakPolarHBondContact O-CB 3.37Å; L405-R409 VanDerWaalsContact O-CG 3.26Å; L405-R409 WeakPolarHBondContact O-CG 3.49Å; L405-R409 PolarHBondContact O-N 2.97Å; L405-R409 VanDerWaalsContact O-N 3.09Å; L405-T433 HydrophobicContact CD1-CG2 3.93Å; L405-T433 HydrophobicContact CD2-CG2 4.18Å; L405-T433 HydrophobicContact CG-CG2 3.76Å; L405-E436 HydrophobicContact CD1-CG 4.31Å; L405-E436 HydrophobicContact CD2-CB 3.88Å; L405-E436 HydrophobicContact CD2-CG 3.58Å; L405-I437 HydrophobicContact CD2-CG1 3.9Å; L405-L440 HydrophobicContact CD2-CD1 3.94Å
406	A	98.1	Very high	96.7	Very high	16 Å²	16	38.5 Å²	38.5	13%	0.132	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-46.3	170.2	0	0	0	0	0	110.6	F377 A380 K402 G403 I404 R409 A410	F377-A406 HydrophobicContact CD1-CB 3.51Å; F377-A406 HydrophobicContact CE1-CB 3.68Å; A380-A406 VanDerWaalsContact CB-C 3.47Å; A380-A406 HydrophobicContact CB-CB 3.75Å; A380-A406 WeakPolarHBondContact CB-O 3.37Å; K402-A406 PolarHBondContact O-N 3.48Å; G403-A406 WeakPolarHBondContact O-CB 3.37Å; G403-A406 PolarHBondContact O-N 2.73Å; G403-A406 VanDerWaalsContact O-N 3.12Å; I404-A406 VanDerWaalsContact C-N 3.31Å; I404-A406 PolarHBondContact O-N 3.11Å; A406-R409 PolarHBondContact O-N 3.23Å; A406-A410 PolarHBondContact O-N 2.98Å
407	I	98	Very high	96.8	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-59.9	-49.4	176.7	-65.6	168.4	0	0	0	110.6	A376 I379 A380 L383 L394 G403 I404 R409 A410 L411 L420	A376-I407 HydrophobicContact CB-CD1 4.1Å; I379-I407 HydrophobicContact CG2-CD1 4.07Å; I379-I407 HydrophobicContact CG2-CG1 4.08Å; A380-I407 HydrophobicContact CB-CG1 4.19Å; L383-I407 HydrophobicContact CD1-CG2 3.9Å; L394-I407 HydrophobicContact CD1-CD1 3.51Å; G403-I407 PolarHBondContact O-N 2.88Å; G403-I407 VanDerWaalsContact O-N 3.11Å; I404-I407 PolarHBondContact O-N 3.02Å; I407-R409 VanDerWaalsContact C-N 3.27Å; I407-R409 PolarHBondContact O-N 2.83Å; I407-A410 WeakPolarHBondContact O-CA 3.33Å; I407-A410 VanDerWaalsContact O-CB 3.31Å; I407-A410 WeakPolarHBondContact O-CB 3.36Å; I407-A410 PolarHBondContact O-N 2.98Å; I407-L411 WeakPolarHBondContact O-CG 3.38Å; I407-L411 PolarHBondContact O-N 2.93Å; I407-L420 HydrophobicContact CG2-CD1 4.37Å; I407-L420 HydrophobicContact CG2-CD2 3.85Å
408	F	97.9	Very high	96.8	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.009	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-29.3	177.5	-84.1	-80.4	0	0	0	114.1	I404 L411 L420 F422 I437 L440 L441 L450	I404-F408 HydrophobicContact CG2-CD2 3.83Å; I404-F408 HydrophobicContact CG2-CE2 3.8Å; I404-F408 WeakPolarHBondContact O-CD2 3.5Å; I404-F408 PolarHBondContact O-N 2.84Å; F408-L411 HydrophobicContact CD1-CD1 4.16Å; F408-L411 HydrophobicContact CE1-CD1 4.3Å; F408-L411 PolarHBondContact O-N 3.43Å; F408-L420 HydrophobicContact CE2-CD2 4.18Å; F408-L420 HydrophobicContact CZ-CD2 4.07Å; F408-F422 AromaticContact CE2-CE1 3.59Å; F408-F422 HydrophobicContact CE2-CE1 3.59Å; F408-F422 AromaticContact CE2-CZ 3.65Å; F408-F422 HydrophobicContact CE2-CZ 3.65Å; F408-F422 HydrophobicContact CZ-CE1 4.01Å; F408-F422 HydrophobicContact CZ-CZ 4.18Å; F408-I437 HydrophobicContact CD1-CG2 4.2Å; F408-I437 HydrophobicContact CD2-CB 4.47Å; F408-I437 HydrophobicContact CD2-CD1 4.22Å; F408-I437 HydrophobicContact CD2-CG1 3.73Å; F408-I437 HydrophobicContact CD2-CG2 4.19Å; F408-I437 HydrophobicContact CE1-CG2 3.79Å; F408-I437 HydrophobicContact CE2-CB 4.43Å; F408-I437 HydrophobicContact CE2-CD1 3.97Å; F408-I437 HydrophobicContact CE2-CG1 3.86Å; F408-I437 HydrophobicContact CE2-CG2 3.78Å; F408-I437 HydrophobicContact CG-CG1 4.28Å; F408-I437 HydrophobicContact CG-CG2 4.39Å; F408-I437 HydrophobicContact CZ-CG2 3.56Å; F408-L440 HydrophobicContact CB-CB 4.27Å; F408-L440 HydrophobicContact CB-CD1 3.73Å; F408-L441 HydrophobicContact CE1-CD1 4.38Å; F408-L450 HydrophobicContact CE1-CD2 4.35Å; F408-L450 HydrophobicContact CZ-CD1 3.79Å; F408-L450 HydrophobicContact CZ-CD2 3.78Å; F408-L450 HydrophobicContact CZ-CG 4.48Å
409	R	97.5	Very high	96.9	Very high	119 Å²	119	36.2 Å²	36.2	45%	0.449	18%	0.18	S	C	.	.	H	α-helix	trans	-72.7	-30.9	172.2	-73.5	170.5	-177.8	139.7	4.8	112.3	L405 A406 I407 L412 E436 L440	L405-R409 WeakPolarHBondContact O-CB 3.37Å; L405-R409 VanDerWaalsContact O-CG 3.26Å; L405-R409 WeakPolarHBondContact O-CG 3.49Å; L405-R409 PolarHBondContact O-N 2.97Å; L405-R409 VanDerWaalsContact O-N 3.09Å; A406-R409 PolarHBondContact O-N 3.23Å; I407-R409 VanDerWaalsContact C-N 3.27Å; I407-R409 PolarHBondContact O-N 2.83Å; R409-L412 WeakPolarHBondContact O-CB 3.41Å; R409-L412 PolarHBondContact O-N 2.93Å; R409-E436 IonicContact CZ-OE1 3.85Å; R409-E436 IonicContact NH2-OE1 3.47Å; R409-E436 PolarHBondContact NH2-OE1 2.9Å; R409-L440 HydrophobicContact CG-CD1 3.87Å; R409-L440 HydrophobicContact CG-CD2 3.95Å
410	A	97.4	Very high	97	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-35.8	169.6	0	0	0	0	0	112.1	A380 L383 K384 A406 I407 L412 Q413 N414	A380-A410 HydrophobicContact CB-CB 4.23Å; A380-A410 WeakPolarHBondContact O-CB 3.39Å; L383-A410 HydrophobicContact CB-CB 4.11Å; K384-A410 HydrophobicContact CG-CB 3.99Å; A406-A410 PolarHBondContact O-N 2.98Å; I407-A410 WeakPolarHBondContact O-CA 3.33Å; I407-A410 VanDerWaalsContact O-CB 3.31Å; I407-A410 WeakPolarHBondContact O-CB 3.36Å; I407-A410 PolarHBondContact O-N 2.98Å; A410-L412 PolarHBondContact O-N 3.23Å; A410-L412 VanDerWaalsContact O-N 3.11Å; A410-Q413 PolarHBondContact O-N 2.78Å; A410-N414 PolarHBondContact O-N 3.18Å
411	L	96.9	Very high	97.1	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.4	176.6	-62.1	-172.6	0	0	0	114.9	L383 I407 F408 Q413 N414 L417 L420 N444 L447	L383-L411 HydrophobicContact CD1-CD2 4.34Å; I407-L411 WeakPolarHBondContact O-CG 3.38Å; I407-L411 PolarHBondContact O-N 2.93Å; F408-L411 HydrophobicContact CD1-CD1 4.16Å; F408-L411 HydrophobicContact CE1-CD1 4.3Å; F408-L411 PolarHBondContact O-N 3.43Å; L411-Q413 VanDerWaalsContact C-N 3.28Å; L411-N414 HydrophobicContact CD2-CB 4.14Å; L411-L417 HydrophobicContact CD2-CB 4.17Å; L411-L417 HydrophobicContact CD2-CD2 3.72Å; L411-L420 HydrophobicContact CD1-CD2 4.05Å; L411-N444 PolarHBondContact O-ND2 3.3Å; L411-L447 HydrophobicContact CD1-CD2 4.35Å
412	L	95.9	Very high	97.1	Very high	69 Å²	69	38.5 Å²	38.5	36%	0.361	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.4	166.7	-57.8	-178.2	0	0	0	112.4	R409 A410 L440 E443	R409-L412 WeakPolarHBondContact O-CB 3.41Å; R409-L412 PolarHBondContact O-N 2.93Å; A410-L412 PolarHBondContact O-N 3.23Å; A410-L412 VanDerWaalsContact O-N 3.11Å; L412-L440 HydrophobicContact CD1-CD2 3.9Å; L412-L440 HydrophobicContact CD2-CD2 4.39Å; L412-L440 WeakPolarHBondContact CD2-O 3.28Å; L412-L440 HydrophobicContact CG-CD2 4.4Å; L412-E443 HydrophobicContact CD2-CB 3.85Å
413	Q	94.4	Very high	97.1	Very high	127 Å²	127	35 Å²	35	59%	0.593	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-8.7	-177.3	-64.2	176	-25.2	0	0	112.6	K387 A410 L411	K387-Q413 PolarHBondContact NZ-O 3.19Å; A410-Q413 PolarHBondContact O-N 2.78Å; L411-Q413 VanDerWaalsContact C-N 3.28Å
414	N	95.7	Very high	97	Very high	3 Å²	3	41 Å²	41	2%	0.016	20%	0.2	C	C	.	.			trans	-96.2	132.1	171	-171.2	-78.5	0	0	0	111.1	L383 N386 A410 L411 T416 L417 N444	L383-N414 WeakPolarHBondContact O-CB 3.43Å; L383-N414 PolarHBondContact O-ND2 3.13Å; N386-N414 PolarHBondContact O-ND2 3.21Å; A410-N414 PolarHBondContact O-N 3.18Å; L411-N414 HydrophobicContact CD2-CB 4.14Å; N414-T416 PolarHBondContact ND2-OG1 2.88Å; N414-T416 PolarHBondContact OD1-N 3.06Å; N414-T416 PolarHBondContact OD1-OG1 3.38Å; N414-L417 WeakPolarHBondContact OD1-CB 3.26Å; N414-L417 PolarHBondContact OD1-N 3.41Å; N414-N444 PolarHBondContact O-ND2 2.74Å; N414-N444 VanDerWaalsContact O-ND2 3.15Å
415	N	95	Very high	96.9	Very high	106 Å²	106	42.1 Å²	42.1	57%	0.567	20%	0.204	S	C	*	.	S	Bend	trans	-123.6	20.1	179.4	62.4	-23.5	0	0	0	112.7	T446	N415-T446 HydrophobicContact CB-CG2 3.96Å; N415-T446 WeakPolarHBondContact O-CG2 3.44Å
416	T	96.7	Very high	96.6	Very high	27 Å²	27	49.3 Å²	49.3	17%	0.166	23%	0.23	C	C	.	.	S	Bend	trans	-125.8	-29.3	-170.8	68.8	0	0	0	0	113.1	K387 I389 N414 T418	K387-T416 HydrophobicContact CB-CG2 3.89Å; K387-T416 HydrophobicContact CD-CG2 3.99Å; K387-T416 WeakPolarHBondContact O-CG2 3.45Å; I389-T416 CarbonylContact O-C 3.38Å; I389-T416 PolarHBondContact O-OG1 3.38Å; N414-T416 PolarHBondContact ND2-OG1 2.88Å; N414-T416 PolarHBondContact OD1-N 3.06Å; N414-T416 PolarHBondContact OD1-OG1 3.38Å; T416-T418 PolarHBondContact O-N 3.16Å
417	L	97.8	Very high	96	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	25%	0.246	C	C	.	.			trans	-70	127.1	174.3	-162.8	76.1	0	0	0	110.1	L383 I389 L392 L411 N414 L420 T446 L447	L383-L417 HydrophobicContact CD2-CD1 4.41Å; L383-L417 HydrophobicContact CD2-CD2 4.35Å; I389-L417 HydrophobicContact CG2-CD1 3.86Å; L392-L417 HydrophobicContact CB-CD1 3.84Å; L392-L417 HydrophobicContact CB-CD2 4.28Å; L411-L417 HydrophobicContact CD2-CB 4.17Å; L411-L417 HydrophobicContact CD2-CD2 3.72Å; N414-L417 WeakPolarHBondContact OD1-CB 3.26Å; N414-L417 PolarHBondContact OD1-N 3.41Å; L417-L420 HydrophobicContact CD2-CB 4.04Å; L417-T446 CarbonylContact O-C 3.53Å; L417-T446 PolarHBondContact O-OG1 3.11Å; L417-L447 HydrophobicContact CD2-CD1 4.33Å; L417-L447 HydrophobicContact CG-CD1 4.44Å
418	T	97.6	Very high	95.4	Very high	34 Å²	34	59.3 Å²	59.3	21%	0.209	28%	0.277	C	S	.	.			trans	-114.8	-26.9	-178.7	65.8	0	0	0	0	112.8	T390 T416 L448 K449	T390-T418 WeakPolarHBondContact O-CA 3.46Å; T390-T418 PolarHBondContact O-N 2.64Å; T390-T418 PolarHBondContact O-OG1 3.23Å; T416-T418 PolarHBondContact O-N 3.16Å; T418-L448 HydrophobicContact CG2-CD1 4.34Å; T418-L448 PolarHBondContact O-N 3.12Å; T418-K449 PolarHBondContact O-N 3.01Å
419	E	98.2	Very high	94.9	Very high	30 Å²	30	59.6 Å²	59.6	14%	0.14	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.9	174.4	-52.5	-161.8	-166.7	0	0	110.8	T390 S391 L392 R421 K449	T390-E419 PolarHBondContact O-N 2.81Å; S391-E419 WeakPolarHBondContact CA-O 3.46Å; L392-E419 PolarHBondContact N-O 2.76Å; E419-R421 IonicContact OE2-CZ 2.62Å; E419-R421 IonicContact OE2-NE 2.73Å; E419-R421 IonicContact OE2-NH2 2.61Å; E419-R421 PolarHBondContact OE2-NH2 3.11Å; E419-K449 WeakPolarHBondContact CA-O 3.32Å; E419-K449 HydrophobicContact CB-CB 4.45Å; E419-K449 HydrophobicContact CG-CB 4.06Å; E419-K449 HydrophobicContact CG-CD 4.07Å; E419-K449 HydrophobicContact CG-CG 4.21Å; E419-K449 WeakPolarHBondContact OE1-CD 3.47Å; E419-K449 VanDerWaalsContact OE1-CE 3.26Å; E419-K449 WeakPolarHBondContact OE1-CE 3.31Å; E419-K449 IonicContact OE1-NZ 2.91Å; E419-K449 PolarHBondContact OE1-NZ 3.42Å; E419-K449 IonicContact OE2-NZ 3.92Å
420	L	98.3	Very high	94.7	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134.3	170	173	61.2	0	0	0	108.1	L392 L394 I407 F408 L411 L417 F422 L447 K449 L450 G451	L392-L420 HydrophobicContact CB-CD1 4.19Å; L392-L420 HydrophobicContact CD2-CD1 3.9Å; L392-L420 HydrophobicContact CG-CD1 4.02Å; L392-L420 CarbonylContact O-C 3.53Å; L392-L420 WeakPolarHBondContact O-CA 3.41Å; L394-L420 HydrophobicContact CD1-CD1 4.3Å; I407-L420 HydrophobicContact CG2-CD1 4.37Å; I407-L420 HydrophobicContact CG2-CD2 3.85Å; F408-L420 HydrophobicContact CE2-CD2 4.18Å; F408-L420 HydrophobicContact CZ-CD2 4.07Å; L411-L420 HydrophobicContact CD1-CD2 4.05Å; L417-L420 HydrophobicContact CD2-CB 4.04Å; L420-F422 HydrophobicContact CD1-CD1 4.4Å; L420-F422 HydrophobicContact CD2-CD1 4.18Å; L420-F422 HydrophobicContact CD2-CE1 3.94Å; L420-F422 HydrophobicContact CG-CD1 3.98Å; L420-F422 HydrophobicContact CG-CE1 4.15Å; L420-L447 HydrophobicContact CB-CD1 3.92Å; L420-K449 PolarHBondContact N-O 3.22Å; L420-L450 HydrophobicContact CB-CD1 4.22Å; L420-L450 HydrophobicContact CD2-CD1 4.22Å; L420-L450 HydrophobicContact CG-CD1 4.18Å; L420-L450 CarbonylContact O-C 3.53Å; L420-L450 WeakPolarHBondContact O-CA 3.36Å; L420-G451 PolarHBondContact O-N 3.25Å
421	R	98.1	Very high	94.6	Very high	96 Å²	96	56.3 Å²	56.3	36%	0.362	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.5	176.5	-46.3	-175.4	-168.9	166.9	5.7	110.7	L392 L394 D395 E419 G451	L392-R421 PolarHBondContact O-N 3.21Å; L394-R421 WeakPolarHBondContact CA-O 3.43Å; L394-R421 WeakPolarHBondContact CB-O 3.38Å; L394-R421 PolarHBondContact N-O 2.98Å; D395-R421 VanDerWaalsContact OD1-C 3.27Å; D395-R421 VanDerWaalsContact OD1-CB 3.28Å; D395-R421 WeakPolarHBondContact OD1-CB 3.47Å; E419-R421 IonicContact OE2-CZ 2.62Å; E419-R421 IonicContact OE2-NE 2.73Å; E419-R421 IonicContact OE2-NH2 2.61Å; E419-R421 PolarHBondContact OE2-NH2 3.11Å; R421-G451 WeakPolarHBondContact CA-O 3.27Å
422	F	97.1	Very high	94.5	Very high	1 Å²	1	65 Å²	65	0%	0.004	32%	0.32	C	S	.	.			trans	-152.4	40.2	174.7	56.2	-92.9	0	0	0	111.4	L394 D395 I404 F408 L420 Q425 I437 L450 G451 Y452	L394-F422 HydrophobicContact CB-CB 4.16Å; D395-F422 WeakPolarHBondContact OD1-CA 3.37Å; D395-F422 PolarHBondContact OD1-N 2.77Å; I404-F422 HydrophobicContact CD1-CB 3.81Å; I404-F422 HydrophobicContact CD1-CD1 3.97Å; I404-F422 HydrophobicContact CD1-CD2 3.65Å; I404-F422 HydrophobicContact CD1-CE1 4.46Å; I404-F422 HydrophobicContact CD1-CE2 4.2Å; I404-F422 HydrophobicContact CD1-CG 3.55Å; I404-F422 HydrophobicContact CG1-CD2 3.97Å; I404-F422 HydrophobicContact CG1-CE2 4.17Å; I404-F422 HydrophobicContact CG1-CG 4.38Å; I404-F422 HydrophobicContact CG2-CD2 4.23Å; I404-F422 HydrophobicContact CG2-CE1 3.98Å; I404-F422 HydrophobicContact CG2-CE2 3.65Å; I404-F422 HydrophobicContact CG2-CZ 3.53Å; F408-F422 AromaticContact CE2-CE1 3.59Å; F408-F422 HydrophobicContact CE2-CE1 3.59Å; F408-F422 AromaticContact CE2-CZ 3.65Å; F408-F422 HydrophobicContact CE2-CZ 3.65Å; F408-F422 HydrophobicContact CZ-CE1 4.01Å; F408-F422 HydrophobicContact CZ-CZ 4.18Å; L420-F422 HydrophobicContact CD1-CD1 4.4Å; L420-F422 HydrophobicContact CD2-CD1 4.18Å; L420-F422 HydrophobicContact CD2-CE1 3.94Å; L420-F422 HydrophobicContact CG-CD1 3.98Å; L420-F422 HydrophobicContact CG-CE1 4.15Å; F422-Q425 WeakPolarHBondContact O-CG 3.45Å; F422-Q425 PolarHBondContact O-NE2 3.29Å; F422-I437 HydrophobicContact CZ-CD1 4.34Å; F422-L450 HydrophobicContact CD1-CD1 4.37Å; F422-L450 HydrophobicContact CE1-CD1 3.58Å; F422-L450 HydrophobicContact CZ-CD1 4.15Å; F422-G451 PolarHBondContact N-O 3.02Å; F422-Y452 AromaticContact CD2-CD2 3.62Å; F422-Y452 HydrophobicContact CD2-CD2 3.62Å; F422-Y452 HydrophobicContact CD2-CE2 4.35Å; F422-Y452 HydrophobicContact CD2-CG 4.15Å; F422-Y452 HydrophobicContact CE2-CD1 4.22Å; F422-Y452 AromaticContact CE2-CD2 3.24Å; F422-Y452 HydrophobicContact CE2-CD2 3.24Å; F422-Y452 AromaticContact CE2-CE2 3.92Å; F422-Y452 HydrophobicContact CE2-CE2 3.92Å; F422-Y452 AromaticContact CE2-CG 3.43Å; F422-Y452 HydrophobicContact CE2-CG 3.43Å; F422-Y452 VanDerWaalsContact CE2-CG 3.43Å; F422-Y452 HydrophobicContact CZ-CD1 4.49Å; F422-Y452 HydrophobicContact CZ-CD2 4.15Å; F422-Y452 AromaticContact CZ-CG 3.87Å; F422-Y452 HydrophobicContact CZ-CG 3.87Å
423	H	95.5	Very high	94.6	Very high	78 Å²	78	62.5 Å²	62.5	36%	0.361	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	161.4	171.2	-74	-79.4	0	0	0	112.1	D395 S396 Q425 G451 Y452	D395-H423 CarbonylContact C-O 3.44Å; D395-H423 WeakPolarHBondContact CA-O 3.26Å; D395-H423 IonicContact OD1-CD2 3.62Å; D395-H423 PolarHBondContact OD1-N 2.91Å; S396-H423 PolarHBondContact N-O 3.36Å; H423-Q425 VanDerWaalsContact C-N 3.27Å; H423-Q425 PolarHBondContact O-N 3.42Å; H423-Q425 VanDerWaalsContact O-N 3.12Å; H423-Q425 PolarHBondContact O-NE2 3.11Å; H423-Q425 VanDerWaalsContact O-NE2 3.13Å; H423-G451 PolarHBondContact CD2-O 3.21Å; H423-G451 VanDerWaalsContact CD2-O 3.3Å; H423-G451 PolarHBondContact N-O 3.04Å; H423-G451 WeakPolarHBondContact NE2-CA 3.34Å; H423-Y452 PolarHBondContact CE1-N 3.04Å; H423-Y452 PolarHBondContact NE2-N 3.09Å
424	N	94.8	Very high	94.7	Very high	126 Å²	126	56.5 Å²	56.5	67%	0.674	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	32.3	167.4	-163	45.1	0	0	0	115.5	S396	S396-N424 WeakPolarHBondContact CA-O 3.46Å; S396-N424 PolarHBondContact OG-ND2 3.15Å
425	Q	95.4	Very high	94.8	Very high	23 Å²	23	61.4 Å²	61.4	11%	0.107	30%	0.304	C	S	.	.			trans	-63.1	145.2	172	-58	-52.8	-64.9	0	0	110.6	L394 N397 I399 F422 H423 H427	L394-Q425 PolarHBondContact O-NE2 3.34Å; N397-Q425 CarbonylContact O-C 3.59Å; N397-Q425 VanDerWaalsContact O-CA 3.31Å; N397-Q425 WeakPolarHBondContact O-CA 3.44Å; N397-Q425 PolarHBondContact O-OE1 2.94Å; I399-Q425 VanDerWaalsContact N-OE1 3.14Å; F422-Q425 WeakPolarHBondContact O-CG 3.45Å; F422-Q425 PolarHBondContact O-NE2 3.29Å; H423-Q425 VanDerWaalsContact C-N 3.27Å; H423-Q425 PolarHBondContact O-N 3.42Å; H423-Q425 VanDerWaalsContact O-N 3.12Å; H423-Q425 PolarHBondContact O-NE2 3.11Å; H423-Q425 VanDerWaalsContact O-NE2 3.13Å; Q425-H427 PolarHBondContact O-N 3.5Å
426	R	91.3	Very high	94.9	Very high	172 Å²	172	58.4 Å²	58.4	65%	0.649	29%	0.286	S	S	*	.	S	Bend	trans	-54.6	-23.2	178.3	-179	176.1	-177.1	-150.8	2.6	114.2	N397 H398	N397-R426 PolarHBondContact O-N 2.89Å; H398-R426 VanDerWaalsContact CD2-CD 3.48Å; H398-R426 WeakPolarHBondContact CD2-CD 3.37Å
427	H	86	Confident	94.9	Very high	99 Å²	99	57.1 Å²	57.1	46%	0.458	28%	0.278	S	S	.	.	S	Bend	trans	-126.4	131.8	174.3	-62.4	-60.2	0	0	0	111	Q425 C429	Q425-H427 PolarHBondContact O-N 3.5Å; H427-C429 PolarHBondContact O-N 3.32Å
428	I	85.8	Confident	94.9	Very high	128 Å²	128	57.5 Å²	57.5	66%	0.656	28%	0.281	S	S	*	.			trans	-53.4	128	168.5	-178.2	172.1	0	0	0	110.1	G430 E455	I428-G430 PolarHBondContact O-N 3.34Å; I428-E455 HydrophobicContact CD1-CG 3.95Å
429	C	87.8	Confident	94.9	Very high	9 Å²	9	61.8 Å²	61.8	6%	0.061	30%	0.297	C	S	.	.			trans	-61.6	-30.4	-179.9	-80.1	0	0	0	0	112.5	H427 T433 Y452	H427-C429 PolarHBondContact O-N 3.32Å; C429-T433 HydrophobicContact CB-CG2 4.01Å; C429-T433 WeakPolarHBondContact O-CB 3.28Å; C429-T433 PolarHBondContact O-OG1 3.25Å; C429-Y452 HydrophobicContact CB-CE2 4.43Å
430	G	92.9	Very high	94.8	Very high	24 Å²	24	61 Å²	61	25%	0.247	29%	0.294	C	S	.	.			trans	83.2	145.2	174.2	0	0	0	0	0	113.4	I428 K432 T433 E434	I428-G430 PolarHBondContact O-N 3.34Å; G430-K432 PolarHBondContact O-N 2.85Å; G430-T433 WeakPolarHBondContact O-CA 3.4Å; G430-T433 VanDerWaalsContact O-CB 3.23Å; G430-T433 WeakPolarHBondContact O-CB 3.24Å; G430-T433 PolarHBondContact O-N 2.91Å; G430-E434 PolarHBondContact O-N 3.09Å
431	G	95.6	Very high	94.7	Very high	26 Å²	26	61 Å²	61	27%	0.268	29%	0.294	S	S	.	.	H	α-helix	trans	-56.5	-28.3	-169.5	0	0	0	0	0	116.2	T433 E434 M435 L456	G431-T433 VanDerWaalsContact C-N 3.35Å; G431-E434 PolarHBondContact O-N 2.91Å; G431-M435 WeakPolarHBondContact O-CE 3.45Å; G431-M435 WeakPolarHBondContact O-CG 3.23Å; G431-M435 PolarHBondContact O-N 3.09Å; G431-M435 VanDerWaalsContact O-N 3.08Å; G431-L456 VanDerWaalsContact CA-CD1 3.44Å
432	K	95.6	Very high	94.6	Very high	185 Å²	185	63 Å²	63	80%	0.804	31%	0.305	S	S	*	.	H	α-helix	trans	-63	-41.6	173	-68.8	-176.5	179.6	178.9	0	111.9	G430 E436	G430-K432 PolarHBondContact O-N 2.85Å; K432-E436 PolarHBondContact O-N 3.03Å
433	T	96.4	Very high	94.5	Very high	17 Å²	17	69.3 Å²	69.3	10%	0.104	34%	0.335	C	S	.	.	H	α-helix	trans	-66.5	-45	175.6	-51.8	0	0	0	0	110.3	L405 C429 G430 G431 M435 E436 I437	L405-T433 HydrophobicContact CD1-CG2 3.93Å; L405-T433 HydrophobicContact CD2-CG2 4.18Å; L405-T433 HydrophobicContact CG-CG2 3.76Å; C429-T433 HydrophobicContact CB-CG2 4.01Å; C429-T433 WeakPolarHBondContact O-CB 3.28Å; C429-T433 PolarHBondContact O-OG1 3.25Å; G430-T433 WeakPolarHBondContact O-CA 3.4Å; G430-T433 VanDerWaalsContact O-CB 3.23Å; G430-T433 WeakPolarHBondContact O-CB 3.24Å; G430-T433 PolarHBondContact O-N 2.91Å; G431-T433 VanDerWaalsContact C-N 3.35Å; T433-M435 VanDerWaalsContact C-N 3.34Å; T433-M435 PolarHBondContact O-N 3.11Å; T433-E436 PolarHBondContact O-N 2.87Å; T433-I437 HydrophobicContact CG2-CD1 3.94Å; T433-I437 HydrophobicContact CG2-CG1 4.38Å; T433-I437 VanDerWaalsContact O-CG1 3.3Å; T433-I437 WeakPolarHBondContact O-CG1 3.34Å; T433-I437 PolarHBondContact O-N 3.35Å
434	E	97.1	Very high	94.5	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-59.2	-41	179.1	-64.7	-170.1	161.3	0	0	113.2	G430 G431 I437 A438 Y452 F454 E455 L456 P459	G430-E434 PolarHBondContact O-N 3.09Å; G431-E434 PolarHBondContact O-N 2.91Å; E434-I437 PolarHBondContact O-N 3.12Å; E434-A438 PolarHBondContact O-N 3.04Å; E434-Y452 HydrophobicContact CG-CE1 4.04Å; E434-Y452 WeakPolarHBondContact OE1-CE1 2.9Å; E434-Y452 PolarHBondContact OE1-OH 3.05Å; E434-F454 HydrophobicContact CB-CD1 3.94Å; E434-F454 HydrophobicContact CB-CE1 4.31Å; E434-F454 HydrophobicContact CG-CD1 3.97Å; E434-F454 HydrophobicContact CG-CE1 4.48Å; E434-F454 WeakPolarHBondContact OE1-CA 3.34Å; E434-E455 PolarHBondContact OE1-N 3Å; E434-E455 PolarHBondContact OE2-N 2.7Å; E434-L456 VanDerWaalsContact OE2-CB 3.31Å; E434-L456 WeakPolarHBondContact OE2-CB 3.47Å; E434-L456 WeakPolarHBondContact OE2-CG 3.08Å; E434-L456 PolarHBondContact OE2-N 2.93Å; E434-P459 HydrophobicContact CB-CB 4.01Å; E434-P459 HydrophobicContact CB-CG 4.01Å
435	M	97.1	Very high	94.5	Very high	107 Å²	107	62.8 Å²	62.8	53%	0.527	31%	0.305	S	S	.	.	H	α-helix	trans	-65.9	-41.1	175.8	-70.7	-175.9	-68.5	0	0	112.6	G431 T433 A438 K439 L456 P459	G431-M435 WeakPolarHBondContact O-CE 3.45Å; G431-M435 WeakPolarHBondContact O-CG 3.23Å; G431-M435 PolarHBondContact O-N 3.09Å; G431-M435 VanDerWaalsContact O-N 3.08Å; T433-M435 VanDerWaalsContact C-N 3.34Å; T433-M435 PolarHBondContact O-N 3.11Å; M435-A438 PolarHBondContact O-N 2.98Å; M435-K439 WeakPolarHBondContact O-CB 3.41Å; M435-K439 PolarHBondContact O-N 3.16Å; M435-K439 VanDerWaalsContact O-N 3.09Å; M435-L456 HydrophobicContact CG-CD1 4.44Å; M435-P459 HydrophobicContact CG-CG 3.85Å
436	E	97.4	Very high	94.6	Very high	43 Å²	43	63.2 Å²	63.2	20%	0.201	31%	0.309	C	S	.	.	H	α-helix	trans	-70.5	-35.8	176.4	-179.3	80.5	155.9	0	0	111.4	L405 R409 K432 T433 K439 L440	L405-E436 HydrophobicContact CD1-CG 4.31Å; L405-E436 HydrophobicContact CD2-CB 3.88Å; L405-E436 HydrophobicContact CD2-CG 3.58Å; R409-E436 IonicContact CZ-OE1 3.85Å; R409-E436 IonicContact NH2-OE1 3.47Å; R409-E436 PolarHBondContact NH2-OE1 2.9Å; K432-E436 PolarHBondContact O-N 3.03Å; T433-E436 PolarHBondContact O-N 2.87Å; E436-K439 PolarHBondContact O-N 3.06Å; E436-K439 IonicContact OE1-NZ 2.67Å; E436-K439 WeakPolarHBondContact OE2-CD 3.38Å; E436-K439 IonicContact OE2-NZ 3.26Å; E436-K439 PolarHBondContact OE2-NZ 3.18Å; E436-L440 HydrophobicContact CG-CD1 3.94Å; E436-L440 HydrophobicContact CG-CG 4.32Å; E436-L440 WeakPolarHBondContact O-CB 3.16Å; E436-L440 VanDerWaalsContact O-CG 3.27Å; E436-L440 WeakPolarHBondContact O-CG 3.36Å; E436-L440 PolarHBondContact O-N 3.43Å
437	I	97.6	Very high	94.9	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56.9	-50.7	170.6	-72.6	169.7	0	0	0	110.6	I404 L405 F408 F422 T433 E434 K439 L440 L441 F454	I404-I437 HydrophobicContact CG2-CD1 3.79Å; I404-I437 HydrophobicContact CG2-CG1 4.49Å; L405-I437 HydrophobicContact CD2-CG1 3.9Å; F408-I437 HydrophobicContact CD1-CG2 4.2Å; F408-I437 HydrophobicContact CD2-CB 4.47Å; F408-I437 HydrophobicContact CD2-CD1 4.22Å; F408-I437 HydrophobicContact CD2-CG1 3.73Å; F408-I437 HydrophobicContact CD2-CG2 4.19Å; F408-I437 HydrophobicContact CE1-CG2 3.79Å; F408-I437 HydrophobicContact CE2-CB 4.43Å; F408-I437 HydrophobicContact CE2-CD1 3.97Å; F408-I437 HydrophobicContact CE2-CG1 3.86Å; F408-I437 HydrophobicContact CE2-CG2 3.78Å; F408-I437 HydrophobicContact CG-CG1 4.28Å; F408-I437 HydrophobicContact CG-CG2 4.39Å; F408-I437 HydrophobicContact CZ-CG2 3.56Å; F422-I437 HydrophobicContact CZ-CD1 4.34Å; T433-I437 HydrophobicContact CG2-CD1 3.94Å; T433-I437 HydrophobicContact CG2-CG1 4.38Å; T433-I437 VanDerWaalsContact O-CG1 3.3Å; T433-I437 WeakPolarHBondContact O-CG1 3.34Å; T433-I437 PolarHBondContact O-N 3.35Å; E434-I437 PolarHBondContact O-N 3.12Å; I437-K439 VanDerWaalsContact C-N 3.25Å; I437-K439 PolarHBondContact O-N 2.88Å; I437-L440 PolarHBondContact O-N 3.2Å; I437-L441 WeakPolarHBondContact O-CB 3.49Å; I437-L441 PolarHBondContact O-N 3.17Å; I437-F454 HydrophobicContact CB-CE1 4.44Å; I437-F454 HydrophobicContact CG2-CE1 3.94Å; I437-F454 HydrophobicContact CG2-CZ 3.85Å
438	A	96.9	Very high	95.4	Very high	8 Å²	8	51.5 Å²	51.5	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-31.9	179.8	0	0	0	0	0	112.8	E434 M435 P459 T462 V463	E434-A438 PolarHBondContact O-N 3.04Å; M435-A438 PolarHBondContact O-N 2.98Å; A438-P459 HydrophobicContact CB-CB 4.17Å; A438-T462 HydrophobicContact CB-CG2 4.16Å; A438-V463 HydrophobicContact CB-CG2 3.82Å
439	K	97.1	Very high	96	Very high	124 Å²	124	50.9 Å²	50.9	54%	0.539	26%	0.255	S	S	.	.	H	α-helix	trans	-71.7	-48.8	174.8	176.4	179.4	148	-139.3	0	112.1	M435 E436 I437 L441 K442	M435-K439 WeakPolarHBondContact O-CB 3.41Å; M435-K439 PolarHBondContact O-N 3.16Å; M435-K439 VanDerWaalsContact O-N 3.09Å; E436-K439 PolarHBondContact O-N 3.06Å; E436-K439 IonicContact OE1-NZ 2.67Å; E436-K439 WeakPolarHBondContact OE2-CD 3.38Å; E436-K439 IonicContact OE2-NZ 3.26Å; E436-K439 PolarHBondContact OE2-NZ 3.18Å; I437-K439 VanDerWaalsContact C-N 3.25Å; I437-K439 PolarHBondContact O-N 2.88Å; K439-L441 PolarHBondContact O-N 3.38Å; K439-K442 WeakPolarHBondContact O-CB 3.41Å; K439-K442 PolarHBondContact O-N 3.37Å
440	L	97	Very high	96.5	Very high	14 Å²	14	51.6 Å²	51.6	7%	0.073	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-42.2	178.3	-68.5	166.8	0	0	0	111.6	L405 F408 R409 L412 E436 I437 K442 E443	L405-L440 HydrophobicContact CD2-CD1 3.94Å; F408-L440 HydrophobicContact CB-CB 4.27Å; F408-L440 HydrophobicContact CB-CD1 3.73Å; R409-L440 HydrophobicContact CG-CD1 3.87Å; R409-L440 HydrophobicContact CG-CD2 3.95Å; L412-L440 HydrophobicContact CD1-CD2 3.9Å; L412-L440 HydrophobicContact CD2-CD2 4.39Å; L412-L440 WeakPolarHBondContact CD2-O 3.28Å; L412-L440 HydrophobicContact CG-CD2 4.4Å; E436-L440 HydrophobicContact CG-CD1 3.94Å; E436-L440 HydrophobicContact CG-CG 4.32Å; E436-L440 WeakPolarHBondContact O-CB 3.16Å; E436-L440 VanDerWaalsContact O-CG 3.27Å; E436-L440 WeakPolarHBondContact O-CG 3.36Å; E436-L440 PolarHBondContact O-N 3.43Å; I437-L440 PolarHBondContact O-N 3.2Å; L440-K442 PolarHBondContact O-N 2.94Å; L440-K442 VanDerWaalsContact O-N 3.13Å; L440-E443 PolarHBondContact O-N 2.73Å
441	L	96.4	Very high	96.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.5	178.7	-168.8	62.8	0	0	0	113.4	F408 I437 K439 E443 N444 L447 V463 L466 L467	F408-L441 HydrophobicContact CE1-CD1 4.38Å; I437-L441 WeakPolarHBondContact O-CB 3.49Å; I437-L441 PolarHBondContact O-N 3.17Å; K439-L441 PolarHBondContact O-N 3.38Å; L441-E443 VanDerWaalsContact C-N 3.28Å; L441-E443 PolarHBondContact O-N 2.97Å; L441-N444 HydrophobicContact CD1-CB 4.32Å; L441-L447 HydrophobicContact CD1-CB 4.08Å; L441-L447 HydrophobicContact CD1-CD2 3.77Å; L441-V463 HydrophobicContact CD2-CB 4.32Å; L441-V463 HydrophobicContact CD2-CG1 3.72Å; L441-V463 HydrophobicContact CD2-CG2 4.06Å; L441-L466 HydrophobicContact CB-CD1 4.27Å; L441-L466 HydrophobicContact CG-CD1 4.39Å; L441-L467 HydrophobicContact CD2-CD2 4.17Å; L441-L467 HydrophobicContact CD2-CG 4.45Å
442	K	95.9	Very high	96.7	Very high	139 Å²	139	51.2 Å²	51.2	60%	0.604	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-37.6	175.3	-170.2	-178.6	177.6	-175.8	0	111.8	K439 L440 L466 R469	K439-K442 WeakPolarHBondContact O-CB 3.41Å; K439-K442 PolarHBondContact O-N 3.37Å; L440-K442 PolarHBondContact O-N 2.94Å; L440-K442 VanDerWaalsContact O-N 3.13Å; K442-L466 HydrophobicContact CB-CD1 4.31Å; K442-L466 HydrophobicContact CB-CD2 4.43Å; K442-L466 HydrophobicContact CG-CD2 4.32Å; K442-R469 PolarHBondContact O-NH1 3.28Å; K442-R469 PolarHBondContact O-NH2 3.45Å
443	E	94.9	Very high	96.7	Very high	133 Å²	133	47.8 Å²	47.8	62%	0.621	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-41.7	-176.2	-69.3	169.3	-152.8	0	0	111.8	L412 L440 L441 T445	L412-E443 HydrophobicContact CD2-CB 3.85Å; L440-E443 PolarHBondContact O-N 2.73Å; L441-E443 VanDerWaalsContact C-N 3.28Å; L441-E443 PolarHBondContact O-N 2.97Å; E443-T445 PolarHBondContact O-N 3.5Å
444	N	95.8	Very high	96.7	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.053	23%	0.228	C	C	.	.			trans	-63.9	136.9	172.9	179.4	-81.6	0	0	0	111.3	L411 N414 L441 T446 L447 R469 N470	L411-N444 PolarHBondContact O-ND2 3.3Å; N414-N444 PolarHBondContact O-ND2 2.74Å; N414-N444 VanDerWaalsContact O-ND2 3.15Å; L441-N444 HydrophobicContact CD1-CB 4.32Å; N444-T446 PolarHBondContact ND2-OG1 2.88Å; N444-T446 VanDerWaalsContact ND2-OG1 3.08Å; N444-T446 PolarHBondContact OD1-N 2.89Å; N444-T446 PolarHBondContact OD1-OG1 3.09Å; N444-L447 PolarHBondContact OD1-N 3.25Å; N444-R469 PolarHBondContact O-NH2 3.31Å; N444-N470 PolarHBondContact O-ND2 3.45Å
445	T	95.4	Very high	96.5	Very high	57 Å²	57	52.8 Å²	52.8	35%	0.35	25%	0.253	S	S	.	.			trans	-121.3	8.2	-178.8	48.7	0	0	0	0	114.2	E443 N470 K473	E443-T445 PolarHBondContact O-N 3.5Å; T445-N470 WeakPolarHBondContact CA-OD1 3.33Å; T445-K473 HydrophobicContact CG2-CD 4.36Å
446	T	96.4	Very high	96.5	Very high	32 Å²	32	51.2 Å²	51.2	20%	0.196	25%	0.246	C	C	.	.			trans	-115.3	-27.1	-169.1	66	0	0	0	0	113.8	N415 L417 N444 L448	N415-T446 HydrophobicContact CB-CG2 3.96Å; N415-T446 WeakPolarHBondContact O-CG2 3.44Å; L417-T446 CarbonylContact O-C 3.53Å; L417-T446 PolarHBondContact O-OG1 3.11Å; N444-T446 PolarHBondContact ND2-OG1 2.88Å; N444-T446 VanDerWaalsContact ND2-OG1 3.08Å; N444-T446 PolarHBondContact OD1-N 2.89Å; N444-T446 PolarHBondContact OD1-OG1 3.09Å; T446-L448 WeakPolarHBondContact O-CG 3.5Å; T446-L448 PolarHBondContact O-N 2.9Å
447	L	97.6	Very high	96.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.			trans	-67.2	127.4	172.8	-164.1	75.6	0	0	0	109.3	L411 L417 L420 L441 N444 L450 L467 N470	L411-L447 HydrophobicContact CD1-CD2 4.35Å; L417-L447 HydrophobicContact CD2-CD1 4.33Å; L417-L447 HydrophobicContact CG-CD1 4.44Å; L420-L447 HydrophobicContact CB-CD1 3.92Å; L441-L447 HydrophobicContact CD1-CB 4.08Å; L441-L447 HydrophobicContact CD1-CD2 3.77Å; N444-L447 PolarHBondContact OD1-N 3.25Å; L447-L450 HydrophobicContact CD2-CB 4.28Å; L447-L450 HydrophobicContact CD2-CD1 4.45Å; L447-L467 HydrophobicContact CB-CD2 4.4Å; L447-L467 HydrophobicContact CD2-CD2 4.28Å; L447-L467 HydrophobicContact CG-CD2 4.26Å; L447-L467 WeakPolarHBondContact O-CD2 3.42Å; L447-N470 WeakPolarHBondContact O-CB 3.38Å; L447-N470 PolarHBondContact O-ND2 3.46Å
448	L	97.4	Very high	96.4	Very high	24 Å²	24	53.1 Å²	53.1	13%	0.126	27%	0.273	C	S	.	.			trans	-111.8	-33.4	-176.1	-52.8	-178.8	0	0	0	111.9	T418 T446 N470 M471	T418-L448 HydrophobicContact CG2-CD1 4.34Å; T418-L448 PolarHBondContact O-N 3.12Å; T446-L448 WeakPolarHBondContact O-CG 3.5Å; T446-L448 PolarHBondContact O-N 2.9Å; L448-N470 HydrophobicContact CD2-CB 4.03Å; L448-M471 HydrophobicContact CB-CG 4.1Å; L448-M471 HydrophobicContact CD2-CG 4.07Å
449	K	97.8	Very high	96.4	Very high	115 Å²	115	53.2 Å²	53.2	50%	0.5	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.9	177.4	-51.3	-174	-159.9	157.9	0	110.3	T418 E419 L420	T418-K449 PolarHBondContact O-N 3.01Å; E419-K449 WeakPolarHBondContact CA-O 3.32Å; E419-K449 HydrophobicContact CB-CB 4.45Å; E419-K449 HydrophobicContact CG-CB 4.06Å; E419-K449 HydrophobicContact CG-CD 4.07Å; E419-K449 HydrophobicContact CG-CG 4.21Å; E419-K449 WeakPolarHBondContact OE1-CD 3.47Å; E419-K449 VanDerWaalsContact OE1-CE 3.26Å; E419-K449 WeakPolarHBondContact OE1-CE 3.31Å; E419-K449 IonicContact OE1-NZ 2.91Å; E419-K449 PolarHBondContact OE1-NZ 3.42Å; E419-K449 IonicContact OE2-NZ 3.92Å; L420-K449 PolarHBondContact N-O 3.22Å
450	L	98	Very high	96.4	Very high	25 Å²	25	51.6 Å²	51.6	13%	0.131	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	111.1	172	179.5	58.1	0	0	0	109.6	F408 L420 F422 L447 Y452 F454 V463 L467	F408-L450 HydrophobicContact CE1-CD2 4.35Å; F408-L450 HydrophobicContact CZ-CD1 3.79Å; F408-L450 HydrophobicContact CZ-CD2 3.78Å; F408-L450 HydrophobicContact CZ-CG 4.48Å; L420-L450 HydrophobicContact CB-CD1 4.22Å; L420-L450 HydrophobicContact CD2-CD1 4.22Å; L420-L450 HydrophobicContact CG-CD1 4.18Å; L420-L450 CarbonylContact O-C 3.53Å; L420-L450 WeakPolarHBondContact O-CA 3.36Å; F422-L450 HydrophobicContact CD1-CD1 4.37Å; F422-L450 HydrophobicContact CE1-CD1 3.58Å; F422-L450 HydrophobicContact CZ-CD1 4.15Å; L447-L450 HydrophobicContact CD2-CB 4.28Å; L447-L450 HydrophobicContact CD2-CD1 4.45Å; L450-Y452 PolarHBondContact O-N 2.92Å; L450-Y452 VanDerWaalsContact O-N 3.14Å; L450-F454 HydrophobicContact CD2-CE2 3.82Å; L450-F454 HydrophobicContact CD2-CZ 3.72Å; L450-V463 HydrophobicContact CD2-CG1 4Å; L450-L467 HydrophobicContact CB-CD1 3.9Å
451	G	96.5	Very high	96.4	Very high	9 Å²	9	55.9 Å²	55.9	9%	0.093	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	79.5	171	0	0	0	0	0	111.1	L420 R421 F422 H423	L420-G451 PolarHBondContact O-N 3.25Å; R421-G451 WeakPolarHBondContact CA-O 3.27Å; F422-G451 PolarHBondContact N-O 3.02Å; H423-G451 PolarHBondContact CD2-O 3.21Å; H423-G451 VanDerWaalsContact CD2-O 3.3Å; H423-G451 PolarHBondContact N-O 3.04Å; H423-G451 WeakPolarHBondContact NE2-CA 3.34Å
452	Y	96.9	Very high	96.5	Very high	33 Å²	33	59 Å²	59	13%	0.129	30%	0.304	C	S	.	.			trans	-150.5	140	167.6	176.3	-106.7	0	0	0	110	F422 H423 C429 E434 L450 F454	F422-Y452 AromaticContact CD2-CD2 3.62Å; F422-Y452 HydrophobicContact CD2-CD2 3.62Å; F422-Y452 HydrophobicContact CD2-CE2 4.35Å; F422-Y452 HydrophobicContact CD2-CG 4.15Å; F422-Y452 HydrophobicContact CE2-CD1 4.22Å; F422-Y452 AromaticContact CE2-CD2 3.24Å; F422-Y452 HydrophobicContact CE2-CD2 3.24Å; F422-Y452 AromaticContact CE2-CE2 3.92Å; F422-Y452 HydrophobicContact CE2-CE2 3.92Å; F422-Y452 AromaticContact CE2-CG 3.43Å; F422-Y452 HydrophobicContact CE2-CG 3.43Å; F422-Y452 VanDerWaalsContact CE2-CG 3.43Å; F422-Y452 HydrophobicContact CZ-CD1 4.49Å; F422-Y452 HydrophobicContact CZ-CD2 4.15Å; F422-Y452 AromaticContact CZ-CG 3.87Å; F422-Y452 HydrophobicContact CZ-CG 3.87Å; H423-Y452 PolarHBondContact CE1-N 3.04Å; H423-Y452 PolarHBondContact NE2-N 3.09Å; C429-Y452 HydrophobicContact CB-CE2 4.43Å; E434-Y452 HydrophobicContact CG-CE1 4.04Å; E434-Y452 WeakPolarHBondContact OE1-CE1 2.9Å; E434-Y452 PolarHBondContact OE1-OH 3.05Å; L450-Y452 PolarHBondContact O-N 2.92Å; L450-Y452 VanDerWaalsContact O-N 3.14Å; Y452-F454 AromaticContact CD1-CD1 3.89Å; Y452-F454 HydrophobicContact CD1-CD1 3.89Å; Y452-F454 AromaticContact CD1-CD2 3.78Å; Y452-F454 HydrophobicContact CD1-CD2 3.78Å; Y452-F454 AromaticContact CD1-CE1 3.9Å; Y452-F454 HydrophobicContact CD1-CE1 3.9Å; Y452-F454 AromaticContact CD1-CE2 3.78Å; Y452-F454 HydrophobicContact CD1-CE2 3.78Å; Y452-F454 AromaticContact CD1-CG 3.83Å; Y452-F454 HydrophobicContact CD1-CG 3.83Å; Y452-F454 AromaticContact CD1-CZ 3.83Å; Y452-F454 HydrophobicContact CD1-CZ 3.83Å; Y452-F454 HydrophobicContact CE1-CB 4.35Å; Y452-F454 AromaticContact CE1-CD1 3.75Å; Y452-F454 HydrophobicContact CE1-CD1 3.75Å; Y452-F454 HydrophobicContact CE1-CD2 4.34Å; Y452-F454 HydrophobicContact CE1-CE1 4.05Å; Y452-F454 AromaticContact CE1-CG 3.9Å; Y452-F454 HydrophobicContact CE1-CG 3.9Å; Y452-F454 HydrophobicContact CE1-CZ 4.45Å
453	H	95.1	Very high	96.6	Very high	112 Å²	112	52.6 Å²	52.6	52%	0.519	28%	0.276	S	S	.	.			trans	-90.9	111.2	171	-170.6	86	0	0	0	109.1	E455	H453-E455 IonicContact CD2-OE1 2.71Å
454	F	95.8	Very high	96.8	Very high	10 Å²	10	49.9 Å²	49.9	4%	0.044	27%	0.269	C	S	.	.			trans	-77.1	122.9	173.8	-70.2	-90.7	0	0	0	110.1	E434 I437 L450 Y452 P459 R460 V463	E434-F454 HydrophobicContact CB-CD1 3.94Å; E434-F454 HydrophobicContact CB-CE1 4.31Å; E434-F454 HydrophobicContact CG-CD1 3.97Å; E434-F454 HydrophobicContact CG-CE1 4.48Å; E434-F454 WeakPolarHBondContact OE1-CA 3.34Å; I437-F454 HydrophobicContact CB-CE1 4.44Å; I437-F454 HydrophobicContact CG2-CE1 3.94Å; I437-F454 HydrophobicContact CG2-CZ 3.85Å; L450-F454 HydrophobicContact CD2-CE2 3.82Å; L450-F454 HydrophobicContact CD2-CZ 3.72Å; Y452-F454 AromaticContact CD1-CD1 3.89Å; Y452-F454 HydrophobicContact CD1-CD1 3.89Å; Y452-F454 AromaticContact CD1-CD2 3.78Å; Y452-F454 HydrophobicContact CD1-CD2 3.78Å; Y452-F454 AromaticContact CD1-CE1 3.9Å; Y452-F454 HydrophobicContact CD1-CE1 3.9Å; Y452-F454 AromaticContact CD1-CE2 3.78Å; Y452-F454 HydrophobicContact CD1-CE2 3.78Å; Y452-F454 AromaticContact CD1-CG 3.83Å; Y452-F454 HydrophobicContact CD1-CG 3.83Å; Y452-F454 AromaticContact CD1-CZ 3.83Å; Y452-F454 HydrophobicContact CD1-CZ 3.83Å; Y452-F454 HydrophobicContact CE1-CB 4.35Å; Y452-F454 AromaticContact CE1-CD1 3.75Å; Y452-F454 HydrophobicContact CE1-CD1 3.75Å; Y452-F454 HydrophobicContact CE1-CD2 4.34Å; Y452-F454 HydrophobicContact CE1-CE1 4.05Å; Y452-F454 AromaticContact CE1-CG 3.9Å; Y452-F454 HydrophobicContact CE1-CG 3.9Å; Y452-F454 HydrophobicContact CE1-CZ 4.45Å; F454-P459 HydrophobicContact CD1-CB 3.77Å; F454-P459 HydrophobicContact CE1-CB 4.24Å; F454-R460 HydrophobicContact CB-CB 3.66Å; F454-R460 HydrophobicContact CB-CG 4.04Å; F454-R460 HydrophobicContact CG-CB 4.35Å; F454-R460 WeakPolarHBondContact O-CD 3.32Å; F454-R460 PolarHBondContact O-NH1 3.19Å; F454-V463 HydrophobicContact CE1-CG2 4.14Å; F454-V463 HydrophobicContact CE2-CB 4.04Å; F454-V463 HydrophobicContact CE2-CG1 3.74Å; F454-V463 HydrophobicContact CE2-CG2 4.13Å; F454-V463 HydrophobicContact CZ-CB 4.1Å; F454-V463 HydrophobicContact CZ-CG1 4Å; F454-V463 HydrophobicContact CZ-CG2 3.67Å
455	E	94	Very high	96.9	Very high	113 Å²	113	54.7 Å²	54.7	53%	0.528	29%	0.294	S	S	.	.	S	Bend	trans	-68.2	-48.6	173.3	-64.6	-60.2	138.2	0	0	110.2	I428 E434 H453 A457 R460	I428-E455 HydrophobicContact CD1-CG 3.95Å; E434-E455 PolarHBondContact OE1-N 3Å; E434-E455 PolarHBondContact OE2-N 2.7Å; H453-E455 IonicContact CD2-OE1 2.71Å; E455-A457 PolarHBondContact O-N 3.35Å; E455-R460 PolarHBondContact O-NH1 3.06Å
456	L	95.6	Very high	97	Very high	73 Å²	73	52.8 Å²	52.8	38%	0.382	28%	0.282	S	S	.	.	S	Bend	trans	-75.2	124.3	179.9	-63.1	-173.3	0	0	0	111.9	G431 E434 M435 G458 P459 R460	G431-L456 VanDerWaalsContact CA-CD1 3.44Å; E434-L456 VanDerWaalsContact OE2-CB 3.31Å; E434-L456 WeakPolarHBondContact OE2-CB 3.47Å; E434-L456 WeakPolarHBondContact OE2-CG 3.08Å; E434-L456 PolarHBondContact OE2-N 2.93Å; M435-L456 HydrophobicContact CG-CD1 4.44Å; L456-G458 PolarHBondContact O-N 2.84Å; L456-P459 HydrophobicContact CB-CG 3.91Å; L456-P459 HydrophobicContact CD1-CG 4.4Å; L456-P459 WeakPolarHBondContact O-CD 3.48Å; L456-R460 WeakPolarHBondContact O-CB 3.19Å; L456-R460 PolarHBondContact O-N 2.85Å; L456-R460 VanDerWaalsContact O-N 3.09Å
457	A	96.2	Very high	97.1	Very high	41 Å²	41	52.2 Å²	52.2	34%	0.339	28%	0.278	S	S	.	.	H	α-helix	trans	-58.8	-41.4	178.7	0	0	0	0	0	113.3	E455 R460 M461	E455-A457 PolarHBondContact O-N 3.35Å; A457-R460 WeakPolarHBondContact O-CB 3.32Å; A457-R460 PolarHBondContact O-N 3.15Å; A457-R460 VanDerWaalsContact O-N 3.13Å; A457-M461 HydrophobicContact CB-CE 3.9Å; A457-M461 HydrophobicContact CB-SD 4.02Å; A457-M461 VanDerWaalsContact O-CE 3.29Å; A457-M461 WeakPolarHBondContact O-CE 3.49Å; A457-M461 PolarHBondContact O-N 2.99Å
458	G	97.1	Very high	97.1	Very high	42 Å²	42	54.9 Å²	54.9	43%	0.433	30%	0.297	S	S	.	.	H	α-helix	trans	-55.7	-58.5	-179.4	0	0	0	0	0	113.5	L456 R460 T462	L456-G458 PolarHBondContact O-N 2.84Å; G458-R460 VanDerWaalsContact C-N 3.34Å; G458-R460 PolarHBondContact O-N 2.73Å; G458-T462 WeakPolarHBondContact O-CB 3.39Å; G458-T462 PolarHBondContact O-N 2.95Å; G458-T462 PolarHBondContact O-OG1 2.85Å
459	P	97.5	Very high	97.1	Very high	11 Å²	11	57.6 Å²	57.6	7%	0.071	31%	0.305	C	S	.	.	H	α-helix	trans	-52.8	-45.8	168.4	-30.7	38.3	0	0	0	113.4	E434 M435 A438 F454 L456 M461 T462 V463	E434-P459 HydrophobicContact CB-CB 4.01Å; E434-P459 HydrophobicContact CB-CG 4.01Å; M435-P459 HydrophobicContact CG-CG 3.85Å; A438-P459 HydrophobicContact CB-CB 4.17Å; F454-P459 HydrophobicContact CD1-CB 3.77Å; F454-P459 HydrophobicContact CE1-CB 4.24Å; L456-P459 HydrophobicContact CB-CG 3.91Å; L456-P459 HydrophobicContact CD1-CG 4.4Å; L456-P459 WeakPolarHBondContact O-CD 3.48Å; P459-M461 PolarHBondContact O-N 3.37Å; P459-T462 PolarHBondContact O-N 3.46Å; P459-V463 WeakPolarHBondContact O-CB 3.49Å; P459-V463 WeakPolarHBondContact O-CG2 3.35Å; P459-V463 PolarHBondContact O-N 2.82Å
460	R	97.7	Very high	97	Very high	90 Å²	90	52.2 Å²	52.2	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-56.6	-49.6	-179	-167.5	164.7	59.2	-124	3.1	113.6	F454 E455 L456 A457 G458 T464	F454-R460 HydrophobicContact CB-CB 3.66Å; F454-R460 HydrophobicContact CB-CG 4.04Å; F454-R460 HydrophobicContact CG-CB 4.35Å; F454-R460 WeakPolarHBondContact O-CD 3.32Å; F454-R460 PolarHBondContact O-NH1 3.19Å; E455-R460 PolarHBondContact O-NH1 3.06Å; L456-R460 WeakPolarHBondContact O-CB 3.19Å; L456-R460 PolarHBondContact O-N 2.85Å; L456-R460 VanDerWaalsContact O-N 3.09Å; A457-R460 WeakPolarHBondContact O-CB 3.32Å; A457-R460 PolarHBondContact O-N 3.15Å; A457-R460 VanDerWaalsContact O-N 3.13Å; G458-R460 VanDerWaalsContact C-N 3.34Å; G458-R460 PolarHBondContact O-N 2.73Å; R460-T464 WeakPolarHBondContact O-CB 3.47Å; R460-T464 PolarHBondContact O-N 3.31Å; R460-T464 VanDerWaalsContact O-N 3.11Å; R460-T464 PolarHBondContact O-OG1 3.45Å
461	M	97.6	Very high	97	Very high	104 Å²	104	54.9 Å²	54.9	51%	0.512	29%	0.294	S	S	.	.	H	α-helix	trans	-67.6	-41.5	175.8	-79.5	93.1	67.6	0	0	111.6	A457 P459 V463 T464 N465	A457-M461 HydrophobicContact CB-CE 3.9Å; A457-M461 HydrophobicContact CB-SD 4.02Å; A457-M461 VanDerWaalsContact O-CE 3.29Å; A457-M461 WeakPolarHBondContact O-CE 3.49Å; A457-M461 PolarHBondContact O-N 2.99Å; P459-M461 PolarHBondContact O-N 3.37Å; M461-V463 PolarHBondContact O-N 3.46Å; M461-T464 PolarHBondContact O-N 3.03Å; M461-N465 WeakPolarHBondContact O-CB 3.3Å; M461-N465 VanDerWaalsContact O-CG 3.24Å; M461-N465 PolarHBondContact O-N 3.36Å; M461-N465 PolarHBondContact O-ND2 3.3Å
462	T	97.9	Very high	97	Very high	66 Å²	66	56.9 Å²	56.9	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-59.1	-48	179.7	-56.7	0	0	0	0	111.1	A438 G458 P459 N465 L466	A438-T462 HydrophobicContact CB-CG2 4.16Å; G458-T462 WeakPolarHBondContact O-CB 3.39Å; G458-T462 PolarHBondContact O-N 2.95Å; G458-T462 PolarHBondContact O-OG1 2.85Å; P459-T462 PolarHBondContact O-N 3.46Å; T462-N465 PolarHBondContact O-N 3.21Å; T462-L466 HydrophobicContact CG2-CD1 4.1Å; T462-L466 VanDerWaalsContact O-CG 3.31Å; T462-L466 WeakPolarHBondContact O-CG 3.46Å; T462-L466 PolarHBondContact O-N 3.14Å
463	V	97.9	Very high	96.9	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.024	32%	0.318	C	S	.	.	H	α-helix	trans	-67.4	-44	-179.8	167	0	0	0	0	111.8	A438 L441 L450 F454 P459 M461 N465 L466 L467	A438-V463 HydrophobicContact CB-CG2 3.82Å; L441-V463 HydrophobicContact CD2-CB 4.32Å; L441-V463 HydrophobicContact CD2-CG1 3.72Å; L441-V463 HydrophobicContact CD2-CG2 4.06Å; L450-V463 HydrophobicContact CD2-CG1 4Å; F454-V463 HydrophobicContact CE1-CG2 4.14Å; F454-V463 HydrophobicContact CE2-CB 4.04Å; F454-V463 HydrophobicContact CE2-CG1 3.74Å; F454-V463 HydrophobicContact CE2-CG2 4.13Å; F454-V463 HydrophobicContact CZ-CB 4.1Å; F454-V463 HydrophobicContact CZ-CG1 4Å; F454-V463 HydrophobicContact CZ-CG2 3.67Å; P459-V463 WeakPolarHBondContact O-CB 3.49Å; P459-V463 WeakPolarHBondContact O-CG2 3.35Å; P459-V463 PolarHBondContact O-N 2.82Å; M461-V463 PolarHBondContact O-N 3.46Å; V463-N465 PolarHBondContact O-N 2.88Å; V463-L466 PolarHBondContact O-N 2.83Å; V463-L466 VanDerWaalsContact O-N 3.11Å; V463-L467 HydrophobicContact CG1-CD1 3.99Å; V463-L467 HydrophobicContact CG1-CG 4.26Å; V463-L467 WeakPolarHBondContact O-CG 3.36Å; V463-L467 PolarHBondContact O-N 3.12Å
464	T	97.8	Very high	96.9	Very high	77 Å²	77	58.6 Å²	58.6	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-55.6	-41.9	174.8	-59.3	0	0	0	0	111.6	R460 M461 S468	R460-T464 WeakPolarHBondContact O-CB 3.47Å; R460-T464 PolarHBondContact O-N 3.31Å; R460-T464 VanDerWaalsContact O-N 3.11Å; R460-T464 PolarHBondContact O-OG1 3.45Å; M461-T464 PolarHBondContact O-N 3.03Å; T464-S468 WeakPolarHBondContact O-CB 3.38Å; T464-S468 PolarHBondContact O-N 3.11Å; T464-S468 PolarHBondContact O-OG 3.44Å
465	N	97.9	Very high	96.9	Very high	110 Å²	110	64.4 Å²	64.4	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-68.4	-39.2	177.1	-68.6	-10.7	0	0	0	112.4	M461 T462 V463 S468 R469	M461-N465 WeakPolarHBondContact O-CB 3.3Å; M461-N465 VanDerWaalsContact O-CG 3.24Å; M461-N465 PolarHBondContact O-N 3.36Å; M461-N465 PolarHBondContact O-ND2 3.3Å; T462-N465 PolarHBondContact O-N 3.21Å; V463-N465 PolarHBondContact O-N 2.88Å; N465-S468 PolarHBondContact O-N 2.83Å; N465-R469 WeakPolarHBondContact O-CB 3.31Å; N465-R469 PolarHBondContact O-N 3.49Å
466	L	98	Very high	97	Very high	18 Å²	18	64.3 Å²	64.3	9%	0.094	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-43.3	176.8	-71.5	169.9	0	0	0	112.7	L441 K442 T462 V463 S468 R469 N470	L441-L466 HydrophobicContact CB-CD1 4.27Å; L441-L466 HydrophobicContact CG-CD1 4.39Å; K442-L466 HydrophobicContact CB-CD1 4.31Å; K442-L466 HydrophobicContact CB-CD2 4.43Å; K442-L466 HydrophobicContact CG-CD2 4.32Å; T462-L466 HydrophobicContact CG2-CD1 4.1Å; T462-L466 VanDerWaalsContact O-CG 3.31Å; T462-L466 WeakPolarHBondContact O-CG 3.46Å; T462-L466 PolarHBondContact O-N 3.14Å; V463-L466 PolarHBondContact O-N 2.83Å; V463-L466 VanDerWaalsContact O-N 3.11Å; L466-S468 VanDerWaalsContact C-N 3.33Å; L466-R469 WeakPolarHBondContact O-CB 3.31Å; L466-R469 PolarHBondContact O-N 2.9Å; L466-N470 PolarHBondContact O-N 3.1Å; L466-N470 PolarHBondContact O-OD1 2.84Å; L466-N470 VanDerWaalsContact O-OD1 3.1Å
467	L	97.9	Very high	96.9	Very high	20 Å²	20	66.6 Å²	66.6	11%	0.105	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-38.8	174.8	-64	177.2	0	0	0	111.3	L441 L447 L450 V463 N470 M471	L441-L467 HydrophobicContact CD2-CD2 4.17Å; L441-L467 HydrophobicContact CD2-CG 4.45Å; L447-L467 HydrophobicContact CB-CD2 4.4Å; L447-L467 HydrophobicContact CD2-CD2 4.28Å; L447-L467 HydrophobicContact CG-CD2 4.26Å; L447-L467 WeakPolarHBondContact O-CD2 3.42Å; L450-L467 HydrophobicContact CB-CD1 3.9Å; V463-L467 HydrophobicContact CG1-CD1 3.99Å; V463-L467 HydrophobicContact CG1-CG 4.26Å; V463-L467 WeakPolarHBondContact O-CG 3.36Å; V463-L467 PolarHBondContact O-N 3.12Å; L467-N470 PolarHBondContact O-N 2.94Å; L467-M471 WeakPolarHBondContact O-CG 3.45Å; L467-M471 PolarHBondContact O-N 3.37Å
468	S	97.8	Very high	96.8	Very high	56 Å²	56	70.6 Å²	70.6	39%	0.392	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-43.3	174.4	-59.6	0	0	0	0	112.2	T464 N465 L466 N470 M471 D472	T464-S468 WeakPolarHBondContact O-CB 3.38Å; T464-S468 PolarHBondContact O-N 3.11Å; T464-S468 PolarHBondContact O-OG 3.44Å; N465-S468 PolarHBondContact O-N 2.83Å; L466-S468 VanDerWaalsContact C-N 3.33Å; S468-N470 VanDerWaalsContact C-N 3.35Å; S468-N470 PolarHBondContact O-N 3.04Å; S468-M471 PolarHBondContact O-N 3.08Å; S468-D472 PolarHBondContact O-N 3.19Å
469	R	97.3	Very high	96.7	Very high	81 Å²	81	73.9 Å²	73.9	31%	0.306	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-43.7	171.5	178.1	-158.3	70.7	172.8	-3	111.7	K442 N444 N465 L466 D472 K473	K442-R469 PolarHBondContact O-NH1 3.28Å; K442-R469 PolarHBondContact O-NH2 3.45Å; N444-R469 PolarHBondContact O-NH2 3.31Å; N465-R469 WeakPolarHBondContact O-CB 3.31Å; N465-R469 PolarHBondContact O-N 3.49Å; L466-R469 WeakPolarHBondContact O-CB 3.31Å; L466-R469 PolarHBondContact O-N 2.9Å; R469-D472 PolarHBondContact O-N 3.09Å; R469-K473 PolarHBondContact O-N 3.45Å
470	N	97.3	Very high	96.6	Very high	1 Å²	1	79 Å²	79	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-68.6	-42	-178.6	-65.6	-0.6	0	0	0	111.4	N444 T445 L447 L448 L466 L467 S468 D472 K473 Q474	N444-N470 PolarHBondContact O-ND2 3.45Å; T445-N470 WeakPolarHBondContact CA-OD1 3.33Å; L447-N470 WeakPolarHBondContact O-CB 3.38Å; L447-N470 PolarHBondContact O-ND2 3.46Å; L448-N470 HydrophobicContact CD2-CB 4.03Å; L466-N470 PolarHBondContact O-N 3.1Å; L466-N470 PolarHBondContact O-OD1 2.84Å; L466-N470 VanDerWaalsContact O-OD1 3.1Å; L467-N470 PolarHBondContact O-N 2.94Å; S468-N470 VanDerWaalsContact C-N 3.35Å; S468-N470 PolarHBondContact O-N 3.04Å; N470-D472 VanDerWaalsContact C-N 3.32Å; N470-D472 PolarHBondContact O-N 3.13Å; N470-K473 PolarHBondContact O-N 3.2Å; N470-Q474 PolarHBondContact O-N 2.73Å
471	M	97.3	Very high	96.4	Very high	81 Å²	81	78.8 Å²	78.8	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-61.6	-37.2	171.7	-74.9	-169.8	-74.1	0	0	112.7	L448 L467 S468 Q474 R475	L448-M471 HydrophobicContact CB-CG 4.1Å; L448-M471 HydrophobicContact CD2-CG 4.07Å; L467-M471 WeakPolarHBondContact O-CG 3.45Å; L467-M471 PolarHBondContact O-N 3.37Å; S468-M471 PolarHBondContact O-N 3.08Å; M471-Q474 PolarHBondContact O-N 3.07Å; M471-R475 PolarHBondContact O-N 3.31Å
472	D	96.8	Very high	96.1	Very high	52 Å²	52	79.3 Å²	79.3	28%	0.278	38%	0.379	S	S	.	.	H	α-helix	trans	-68.3	-45.8	175.6	-165.4	62.7	0	0	0	112.3	S468 R469 N470 Q474 R475 Q476	S468-D472 PolarHBondContact O-N 3.19Å; R469-D472 PolarHBondContact O-N 3.09Å; N470-D472 VanDerWaalsContact C-N 3.32Å; N470-D472 PolarHBondContact O-N 3.13Å; D472-Q474 VanDerWaalsContact C-N 3.26Å; D472-Q474 PolarHBondContact O-N 2.74Å; D472-R475 CarbonylContact O-C 3.6Å; D472-R475 WeakPolarHBondContact O-CA 3.39Å; D472-R475 WeakPolarHBondContact O-CB 3.38Å; D472-R475 PolarHBondContact O-N 3.17Å; D472-R475 IonicContact OD1-CZ 3.79Å; D472-R475 IonicContact OD1-NE 2.73Å; D472-R475 PolarHBondContact OD1-NE 3.07Å; D472-R475 IonicContact OD1-NH2 3.27Å; D472-R475 PolarHBondContact OD1-NH2 2.93Å; D472-Q476 WeakPolarHBondContact O-CG 3.49Å; D472-Q476 PolarHBondContact O-N 2.67Å; D472-Q476 PolarHBondContact OD2-NE2 3.12Å
473	K	95.3	Very high	95.9	Very high	102 Å²	102	84 Å²	84	44%	0.443	39%	0.389	S	S	.	.	H	α-helix	trans	-53.6	-43.4	172.1	-77.1	-171.7	170.3	-163.5	0	112.3	T445 R469 N470 R475 Q476 K477	T445-K473 HydrophobicContact CG2-CD 4.36Å; R469-K473 PolarHBondContact O-N 3.45Å; N470-K473 PolarHBondContact O-N 3.2Å; K473-R475 VanDerWaalsContact C-N 3.33Å; K473-R475 PolarHBondContact O-N 3.36Å; K473-Q476 PolarHBondContact O-N 2.85Å; K473-K477 PolarHBondContact O-N 3.13Å
474	Q	94.1	Very high	95.7	Very high	79 Å²	79	88.8 Å²	88.8	37%	0.369	41%	0.412	S	S	.	.	H	α-helix	trans	-67.6	-33.2	178	-153.7	-155.8	38	0	0	112.4	N470 M471 D472 R478	N470-Q474 PolarHBondContact O-N 2.73Å; M471-Q474 PolarHBondContact O-N 3.07Å; D472-Q474 VanDerWaalsContact C-N 3.26Å; D472-Q474 PolarHBondContact O-N 2.74Å; Q474-R478 WeakPolarHBondContact O-CG 3.17Å; Q474-R478 PolarHBondContact O-N 3.45Å
475	R	95.9	Very high	95.3	Very high	131 Å²	131	87.4 Å²	87.4	49%	0.494	41%	0.408	S	S	.	.	H	α-helix	trans	-67.6	-46.4	171.7	157.2	172.1	53.8	-120.9	1.6	111.9	M471 D472 K473 K477 R478 L479	M471-R475 PolarHBondContact O-N 3.31Å; D472-R475 CarbonylContact O-C 3.6Å; D472-R475 WeakPolarHBondContact O-CA 3.39Å; D472-R475 WeakPolarHBondContact O-CB 3.38Å; D472-R475 PolarHBondContact O-N 3.17Å; D472-R475 IonicContact OD1-CZ 3.79Å; D472-R475 IonicContact OD1-NE 2.73Å; D472-R475 PolarHBondContact OD1-NE 3.07Å; D472-R475 IonicContact OD1-NH2 3.27Å; D472-R475 PolarHBondContact OD1-NH2 2.93Å; K473-R475 VanDerWaalsContact C-N 3.33Å; K473-R475 PolarHBondContact O-N 3.36Å; R475-K477 PolarHBondContact O-N 2.96Å; R475-R478 PolarHBondContact O-N 2.82Å; R475-L479 PolarHBondContact O-N 2.91Å; R475-L479 VanDerWaalsContact O-N 3.08Å
476	Q	95.6	Very high	94.8	Very high	111 Å²	111	88 Å²	88	52%	0.519	41%	0.408	S	S	.	.	H	α-helix	trans	-58.6	-46.6	177.1	-68.3	178.5	12.3	0	0	110.9	D472 K473 R478 L479 Q480	D472-Q476 WeakPolarHBondContact O-CG 3.49Å; D472-Q476 PolarHBondContact O-N 2.67Å; D472-Q476 PolarHBondContact OD2-NE2 3.12Å; K473-Q476 PolarHBondContact O-N 2.85Å; Q476-R478 PolarHBondContact O-N 3.23Å; Q476-L479 PolarHBondContact O-N 2.99Å; Q476-L479 VanDerWaalsContact O-N 3.14Å; Q476-Q480 PolarHBondContact O-N 3.18Å
477	K	94.4	Very high	94.2	Very high	122 Å²	122	91.3 Å²	91.3	53%	0.53	42%	0.422	S	S	.	.	H	α-helix	trans	-56.9	-48.7	177.2	-170	171.4	-170.7	-76.3	0	112.2	K473 R475 L479 Q480 E481	K473-K477 PolarHBondContact O-N 3.13Å; R475-K477 PolarHBondContact O-N 2.96Å; K477-L479 VanDerWaalsContact C-N 3.3Å; K477-L479 PolarHBondContact O-N 2.78Å; K477-Q480 PolarHBondContact O-N 3.17Å; K477-E481 HydrophobicContact CG-CG 4.48Å; K477-E481 IonicContact NZ-OE1 2.7Å; K477-E481 PolarHBondContact NZ-OE1 2.68Å; K477-E481 WeakPolarHBondContact O-CB 3.23Å; K477-E481 VanDerWaalsContact O-CG 3.27Å; K477-E481 WeakPolarHBondContact O-CG 3.44Å; K477-E481 PolarHBondContact O-N 3.34Å
478	R	94.2	Very high	93.5	Very high	124 Å²	124	93 Å²	93	47%	0.468	44%	0.439	S	S	.	.	H	α-helix	trans	-60.3	-37	176.1	-74.1	-170.1	-60.9	-91.8	0.4	113.3	Q474 R475 Q476 Q482	Q474-R478 WeakPolarHBondContact O-CG 3.17Å; Q474-R478 PolarHBondContact O-N 3.45Å; R475-R478 PolarHBondContact O-N 2.82Å; Q476-R478 PolarHBondContact O-N 3.23Å; R478-Q482 VanDerWaalsContact O-CB 3.24Å; R478-Q482 WeakPolarHBondContact O-CB 3.43Å; R478-Q482 PolarHBondContact O-N 2.94Å
479	L	95.1	Very high	92.5	Very high	112 Å²	112	97.7 Å²	97.7	59%	0.586	45%	0.453	S	S	*	.	H	α-helix	trans	-69.6	-40.3	178.4	-175.7	62.9	0	0	0	111.4	R475 Q476 K477 Q482 R483	R475-L479 PolarHBondContact O-N 2.91Å; R475-L479 VanDerWaalsContact O-N 3.08Å; Q476-L479 PolarHBondContact O-N 2.99Å; Q476-L479 VanDerWaalsContact O-N 3.14Å; K477-L479 VanDerWaalsContact C-N 3.3Å; K477-L479 PolarHBondContact O-N 2.78Å; L479-Q482 PolarHBondContact O-N 3.4Å; L479-R483 WeakPolarHBondContact O-CB 3.31Å; L479-R483 PolarHBondContact O-N 2.9Å
480	Q	94.3	Very high	90.7	Very high	119 Å²	119	95.5 Å²	95.5	56%	0.556	46%	0.455	S	S	*	.	H	α-helix	trans	-65.6	-45.9	175.1	-170.6	176.6	21.6	0	0	111.7	Q476 K477 Q482 R483 Q484	Q476-Q480 PolarHBondContact O-N 3.18Å; K477-Q480 PolarHBondContact O-N 3.17Å; Q480-Q482 VanDerWaalsContact C-N 3.34Å; Q480-Q482 PolarHBondContact O-N 2.71Å; Q480-R483 PolarHBondContact O-N 2.65Å; Q480-Q484 WeakPolarHBondContact O-CG 3.45Å; Q480-Q484 PolarHBondContact O-N 3.09Å
481	E	93.9	Very high	88.6	Confident	84 Å²	84	102.1 Å²	102.1	39%	0.393	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-43.1	174.4	-71.7	166.4	162.7	0	0	111.7	K477 A485	K477-E481 HydrophobicContact CG-CG 4.48Å; K477-E481 IonicContact NZ-OE1 2.7Å; K477-E481 PolarHBondContact NZ-OE1 2.68Å; K477-E481 WeakPolarHBondContact O-CB 3.23Å; K477-E481 VanDerWaalsContact O-CG 3.27Å; K477-E481 WeakPolarHBondContact O-CG 3.44Å; K477-E481 PolarHBondContact O-N 3.34Å; E481-A485 WeakPolarHBondContact O-CB 3.29Å; E481-A485 PolarHBondContact O-N 2.64Å
482	Q	92.5	Very high	86.5	Confident	115 Å²	115	106.5 Å²	106.5	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-64.6	-39.4	176.6	-179	173.1	58.8	0	0	112.2	R478 L479 Q480 Q486	R478-Q482 VanDerWaalsContact O-CB 3.24Å; R478-Q482 WeakPolarHBondContact O-CB 3.43Å; R478-Q482 PolarHBondContact O-N 2.94Å; L479-Q482 PolarHBondContact O-N 3.4Å; Q480-Q482 VanDerWaalsContact C-N 3.34Å; Q480-Q482 PolarHBondContact O-N 2.71Å; Q482-Q486 WeakPolarHBondContact O-CG 3.43Å; Q482-Q486 PolarHBondContact O-N 3.18Å; Q482-Q486 VanDerWaalsContact O-N 3.16Å
483	R	93.8	Very high	84.2	Confident	164 Å²	164	111.8 Å²	111.8	62%	0.619	52%	0.523	S	S	*	.	H	α-helix	trans	-64.8	-51	176.6	178.5	177.6	168.6	169.3	0.8	111.3	L479 Q480 A485 Q486 E487	L479-R483 WeakPolarHBondContact O-CB 3.31Å; L479-R483 PolarHBondContact O-N 2.9Å; Q480-R483 PolarHBondContact O-N 2.65Å; R483-A485 VanDerWaalsContact C-N 3.27Å; R483-A485 PolarHBondContact O-N 2.87Å; R483-Q486 WeakPolarHBondContact O-CA 3.46Å; R483-Q486 WeakPolarHBondContact O-CB 3.4Å; R483-Q486 PolarHBondContact O-N 3.39Å; R483-E487 IonicContact CZ-OE1 2.67Å; R483-E487 VanDerWaalsContact CZ-OE1 3.27Å; R483-E487 IonicContact NE-OE1 2.8Å; R483-E487 PolarHBondContact NE-OE1 3.26Å; R483-E487 IonicContact NE-OE2 3.15Å; R483-E487 IonicContact NH2-OE1 3.71Å; R483-E487 PolarHBondContact NH2-OE1 3.34Å; R483-E487 PolarHBondContact O-N 3.36Å
484	Q	91.8	Very high	82	Confident	105 Å²	105	114 Å²	114	49%	0.491	54%	0.54	S	S	.	.	H	α-helix	trans	-58.8	-39.4	176.7	-71.1	171.5	-16.3	0	0	111.9	Q480 Q486 E487 A488	Q480-Q484 WeakPolarHBondContact O-CG 3.45Å; Q480-Q484 PolarHBondContact O-N 3.09Å; Q484-Q486 PolarHBondContact O-N 3.03Å; Q484-E487 PolarHBondContact O-N 2.91Å; Q484-A488 WeakPolarHBondContact O-CB 3.48Å; Q484-A488 PolarHBondContact O-N 2.99Å
485	A	90.5	Very high	79.7	Confident	49 Å²	49	117.5 Å²	117.5	41%	0.405	56%	0.561	S	S	.	*	H	α-helix	trans	-72.8	-9.2	175.8	0	0	0	0	0	114.7	E481 R483 K489	E481-A485 WeakPolarHBondContact O-CB 3.29Å; E481-A485 PolarHBondContact O-N 2.64Å; R483-A485 VanDerWaalsContact C-N 3.27Å; R483-A485 PolarHBondContact O-N 2.87Å; A485-K489 VanDerWaalsContact O-CD 3.24Å; A485-K489 WeakPolarHBondContact O-CD 3.45Å; A485-K489 VanDerWaalsContact O-CG 3.31Å; A485-K489 WeakPolarHBondContact O-CG 3.44Å
486	Q	86.5	Confident	77.4	Confident	123 Å²	123	117.9 Å²	117.9	58%	0.575	57%	0.572	S	S	*	*	H	α-helix	trans	-93	-44.5	167.8	-72.4	174.2	21.9	0	0	110.9	Q482 R483 Q484 K489 G490	Q482-Q486 WeakPolarHBondContact O-CG 3.43Å; Q482-Q486 PolarHBondContact O-N 3.18Å; Q482-Q486 VanDerWaalsContact O-N 3.16Å; R483-Q486 WeakPolarHBondContact O-CA 3.46Å; R483-Q486 WeakPolarHBondContact O-CB 3.4Å; R483-Q486 PolarHBondContact O-N 3.39Å; Q484-Q486 PolarHBondContact O-N 3.03Å; Q486-K489 CarbonylContact O-C 3.57Å; Q486-K489 WeakPolarHBondContact O-CA 3.44Å; Q486-K489 WeakPolarHBondContact O-CB 3.39Å; Q486-K489 PolarHBondContact O-N 3.25Å; Q486-G490 PolarHBondContact O-N 2.85Å
487	E	86.8	Confident	74.9	Confident	86 Å²	86	121.6 Å²	121.6	40%	0.402	59%	0.589	S	S	.	*	H	α-helix	trans	-57.2	-51.3	176.7	-70.9	163.5	159	0	0	110.4	R483 Q484 K489 G490 E491	R483-E487 IonicContact CZ-OE1 2.67Å; R483-E487 VanDerWaalsContact CZ-OE1 3.27Å; R483-E487 IonicContact NE-OE1 2.8Å; R483-E487 PolarHBondContact NE-OE1 3.26Å; R483-E487 IonicContact NE-OE2 3.15Å; R483-E487 IonicContact NH2-OE1 3.71Å; R483-E487 PolarHBondContact NH2-OE1 3.34Å; R483-E487 PolarHBondContact O-N 3.36Å; Q484-E487 PolarHBondContact O-N 2.91Å; E487-K489 PolarHBondContact O-N 3.43Å; E487-G490 WeakPolarHBondContact O-CA 3.47Å; E487-G490 PolarHBondContact O-N 3.28Å; E487-E491 PolarHBondContact O-N 3.36Å
488	A	82.6	Confident	72.3	Confident	55 Å²	55	121.8 Å²	121.8	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-67	-2.6	174.9	0	0	0	0	0	115.3	Q484	Q484-A488 WeakPolarHBondContact O-CB 3.48Å; Q484-A488 PolarHBondContact O-N 2.99Å
489	K	76.1	Confident	69.8	Low	155 Å²	155	121.6 Å²	121.6	67%	0.674	62%	0.615	S	S	*	*	H	α-helix	trans	-105.2	-22.7	168.6	-71.6	179.9	-174.4	172.6	0	112.7	A485 Q486 E487	A485-K489 VanDerWaalsContact O-CD 3.24Å; A485-K489 WeakPolarHBondContact O-CD 3.45Å; A485-K489 VanDerWaalsContact O-CG 3.31Å; A485-K489 WeakPolarHBondContact O-CG 3.44Å; Q486-K489 CarbonylContact O-C 3.57Å; Q486-K489 WeakPolarHBondContact O-CA 3.44Å; Q486-K489 WeakPolarHBondContact O-CB 3.39Å; Q486-K489 PolarHBondContact O-N 3.25Å; E487-K489 PolarHBondContact O-N 3.43Å
490	G	59.6	Low	67	Low	35 Å²	35	126.3 Å²	126.3	36%	0.361	63%	0.631	S	S	.	*	H	α-helix	trans	-67	-49.5	170.7	0	0	0	0	0	111.1	Q486 E487 K492 K493	Q486-G490 PolarHBondContact O-N 2.85Å; E487-G490 WeakPolarHBondContact O-CA 3.47Å; E487-G490 PolarHBondContact O-N 3.28Å; G490-K492 PolarHBondContact O-N 3Å; G490-K493 WeakPolarHBondContact O-CB 3.4Å; G490-K493 PolarHBondContact O-N 3.49Å
491	E	54.4	Low	64.4	Low	141 Å²	141	125.7 Å²	125.7	66%	0.659	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-26.3	179.2	-64.4	174.9	150	0	0	113.3	E487 K493	E487-E491 PolarHBondContact O-N 3.36Å; E491-K493 VanDerWaalsContact C-N 3.28Å; E491-K493 PolarHBondContact O-N 2.91Å
492	K	53.3	Low	62	Low	173 Å²	173	125.6 Å²	125.6	75%	0.752	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-1.8	174.5	-75.4	-168.1	173.7	-175.4	0	115	G490	G490-K492 PolarHBondContact O-N 3Å
493	K	48.3	Very low	59.2	Low	162 Å²	162	125 Å²	125	70%	0.704	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-34.5	168.1	-82.9	-170.1	167.8	-171.9	0	113.1	G490 E491 L495 L496	G490-K493 WeakPolarHBondContact O-CB 3.4Å; G490-K493 PolarHBondContact O-N 3.49Å; E491-K493 VanDerWaalsContact C-N 3.28Å; E491-K493 PolarHBondContact O-N 2.91Å; K493-L495 PolarHBondContact O-N 3.21Å; K493-L496 PolarHBondContact O-N 3.48Å
494	D	48.2	Very low	56.9	Low	149 Å²	149	126.1 Å²	126.1	80%	0.797	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-0.5	-174.3	-60.8	-29	0	0	0	113.4
495	L	46	Very low	54.3	Low	153 Å²	153	125.9 Å²	125.9	80%	0.801	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	17.9	174.3	-124.1	162.5	0	0	0	113.4	K493	K493-L495 PolarHBondContact O-N 3.21Å
496	L	48.4	Very low	52.1	Low	139 Å²	139	134 Å²	134	73%	0.728	74%	0.742	S	S	*	*	S	Bend	trans	-103.5	91.4	166.8	-79	169.4	0	0	0	110.1	K493 V498	K493-L496 PolarHBondContact O-N 3.48Å; L496-V498 PolarHBondContact O-N 3.34Å
497	E	41.9	Very low	49.7	Very low	188 Å²	188	131.8 Å²	131.8	88%	0.879	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-54.5	122.8	176.7	-174.6	175.8	-149.3	0	0	111.4	P499	E497-P499 VanDerWaalsContact O-CD 3.31Å; E497-P499 WeakPolarHBondContact O-CD 3.34Å
498	V	41.2	Very low	47.7	Very low	126 Å²	126	133.3 Å²	133.3	76%	0.764	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-80.4	117.8	-178.2	179	0	0	0	0	109.8	L496 K500	L496-V498 PolarHBondContact O-N 3.34Å; V498-K500 PolarHBondContact O-N 3.26Å; V498-K500 VanDerWaalsContact O-N 3.14Å
499	P	41.4	Very low	45.9	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.4	118.3	178.8	-23.1	35.5	0	0	0	111.3	E497 A501	E497-P499 VanDerWaalsContact O-CD 3.31Å; E497-P499 WeakPolarHBondContact O-CD 3.34Å; P499-A501 PolarHBondContact O-N 2.66Å
500	K	35.6	Very low	44.3	Very low	211 Å²	211	139 Å²	139	92%	0.917	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70	116	-174.9	-159.8	171.9	-172.4	173.8	0	110.5	V498 G502	V498-K500 PolarHBondContact O-N 3.26Å; V498-K500 VanDerWaalsContact O-N 3.14Å; K500-G502 PolarHBondContact O-N 2.71Å
501	A	39.4	Very low	43.5	Very low	106 Å²	106	143.4 Å²	143.4	88%	0.876	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-68	125	-179.6	0	0	0	0	0	111.4	P499	P499-A501 PolarHBondContact O-N 2.66Å
502	G	43.3	Very low	42.6	Very low	81 Å²	81	142.3 Å²	142.3	84%	0.835	83%	0.83	S	S	*	*			trans	158.1	44.4	176.1	0	0	0	0	0	118.4	K500	K500-G502 PolarHBondContact O-N 2.71Å
503	A	34.6	Very low	42.2	Very low	103 Å²	103	139.6 Å²	139.6	85%	0.851	83%	0.83	S	S	*	*			trans	-145.7	129.9	167.3	0	0	0	0	0	111.9
504	L	45.3	Very low	42	Very low	187 Å²	187	140.5 Å²	140.5	98%	0.979	84%	0.836	S	S	*	*			trans	-90.7	120.9	175.1	-77.2	163.7	0	0	0	110.2
505	A	36.4	Very low	41.6	Very low	101 Å²	101	138.5 Å²	138.5	84%	0.835	83%	0.832	S	S	*	*			trans	-137.1	128.4	168.2	0	0	0	0	0	110.3
506	K	44.1	Very low	41.3	Very low	220 Å²	220	136.2 Å²	136.2	96%	0.957	83%	0.829	S	S	*	*			trans	-83.5	131.1	173.2	-64.9	176.6	-179.4	175.9	0	109.2
507	G	37.7	Very low	41	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	83%	0.834	S	S	*	*			trans	175.2	112.2	170.6	0	0	0	0	0	112.6
508	S	44.3	Very low	41.2	Very low	119 Å²	119	136.4 Å²	136.4	83%	0.832	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-87.7	125.4	174.2	38.1	0	0	0	0	110.8
509	P	43.7	Very low	41.2	Very low	128 Å²	128	136 Å²	136	83%	0.831	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.8	127.5	177	30	-32.6	0	0	0	111.3
510	K	44.2	Very low	41	Very low	200 Å²	200	135.9 Å²	135.9	87%	0.87	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-82.7	155.2	158.4	-95.7	-177.3	175.7	177.9	0	109.8
511	P	41.7	Very low	41.5	Very low	129 Å²	129	131.7 Å²	131.7	84%	0.838	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-77.3	142.6	-168.9	30.7	-35.9	0	0	0	113.5
512	S	35.6	Very low	41.3	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-99.2	162.3	163.4	41.3	0	0	0	0	111.1
513	P	44.2	Very low	40.6	Very low	116 Å²	116	140.4 Å²	140.4	75%	0.753	83%	0.833	S	S	*	*			trans	-115.7	176.8	-150	42.8	-35.5	0	0	0	116.5
514	Q	44.8	Very low	40.8	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	82%	0.822	S	S	*	*			trans	79.5	152.5	164.9	-65.8	-77	-43.3	0	0	117.4
515	P	40.2	Very low	40.7	Very low	107 Å²	107	137.2 Å²	137.2	70%	0.695	82%	0.817	S	S	*	*			trans	-127.4	167.1	-143.8	42.5	-28.9	0	0	0	116.9
516	S	38.7	Very low	40.8	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-67.5	150.5	171.3	-45.7	0	0	0	0	113.6
517	P	43.3	Very low	40.2	Very low	129 Å²	129	141.7 Å²	141.7	84%	0.838	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-70	153.4	175	29.3	-35	0	0	0	113.1
518	K	44.6	Very low	40	Very low	201 Å²	201	142.2 Å²	142.2	87%	0.874	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-94	142.3	-172.2	-57.5	171.7	-176.4	172.7	0	112.6
519	P	42.4	Very low	39.6	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-93.9	142.9	165.2	35.4	-31.7	0	0	0	112.3
520	S	36.6	Very low	39.5	Very low	119 Å²	119	138.7 Å²	138.7	83%	0.832	82%	0.819	S	S	*	*			trans	-174.4	162.5	167.2	-85.4	0	0	0	0	111.4
521	P	46.4	Very low	39.3	Very low	123 Å²	123	135.2 Å²	135.2	80%	0.799	82%	0.817	S	S	*	*			cis	-119.6	178.3	-10.2	37.3	-22.9	0	0	0	113.2
522	K	34.2	Very low	39.5	Very low	206 Å²	206	133.7 Å²	133.7	90%	0.896	82%	0.816	S	S	*	*			trans	-87.9	152.6	170.8	-59	173.3	-179.3	172.4	0	110.6
523	N	30.7	Very low	40.4	Very low	165 Å²	165	132.4 Å²	132.4	88%	0.882	81%	0.812	S	S	*	*			trans	-142.8	154.5	148.8	-155.4	-3.5	0	0	0	110.3
524	S	38.7	Very low	41	Very low	88 Å²	88	132.4 Å²	132.4	62%	0.615	81%	0.812	S	S	*	*			trans	-164.3	152	-174.7	65	0	0	0	0	112.6
525	P	42.9	Very low	41.5	Very low	135 Å²	135	129.4 Å²	129.4	88%	0.877	81%	0.808	S	S	*	*			trans	-123.6	158.1	135.5	33.3	-23.4	0	0	0	112.6
526	K	37.9	Very low	42.4	Very low	198 Å²	198	129.8 Å²	129.8	86%	0.861	81%	0.811	S	S	*	*			trans	-97.1	132.9	-170.3	-62.2	174.3	-179.1	174.1	0	113.6
527	K	32.3	Very low	43.3	Very low	216 Å²	216	130.2 Å²	130.2	94%	0.939	81%	0.811	S	S	*	*			trans	-140.1	147.3	132.6	-77.1	-174.5	178.8	177.3	0	106.4
528	G	33.2	Very low	43.8	Very low	87 Å²	87	129.5 Å²	129.5	90%	0.897	81%	0.807	S	S	*	*			cis	157.2	52.2	2.6	0	0	0	0	0	111.2
529	G	34.6	Very low	44.4	Very low	76 Å²	76	125.2 Å²	125.2	78%	0.784	80%	0.799	S	S	*	*			trans	-163.4	148.9	-177.7	0	0	0	0	0	111.3
530	A	42.7	Very low	44.8	Very low	96 Å²	96	125.6 Å²	125.6	79%	0.793	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-81.1	144.8	-179.7	0	0	0	0	0	111.5
531	P	40.4	Very low	45.6	Very low	127 Å²	127	127.9 Å²	127.9	83%	0.825	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.2	134.4	170.4	29.6	-33.4	0	0	0	110
532	A	44.8	Very low	45.7	Very low	98 Å²	98	126.2 Å²	126.2	81%	0.81	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65	148.2	172.1	0	0	0	0	0	111.2
533	A	55.2	Low	46.6	Very low	90 Å²	90	121.7 Å²	121.7	74%	0.744	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-62.3	144.6	171.6	0	0	0	0	0	110.6
534	P	57.6	Low	47.6	Very low	116 Å²	116	119.5 Å²	119.5	75%	0.753	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.4	147.7	176	27.9	-34.8	0	0	0	110.8
535	P	54.4	Low	48.1	Very low	117 Å²	117	122.4 Å²	122.4	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-63.2	149.3	176.2	27.9	-34.8	0	0	0	110.9
536	P	59.3	Low	48.9	Very low	115 Å²	115	121.3 Å²	121.3	75%	0.747	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-62.7	150.1	177	27.7	-35	0	0	0	111.1
537	P	58	Low	49.8	Very low	115 Å²	115	119 Å²	119	75%	0.747	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-62.4	149.9	177.5	27.5	-35	0	0	0	111.2
538	P	54	Low	50.9	Low	115 Å²	115	115.4 Å²	115.4	75%	0.747	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-62.3	151.6	175	28	-35	0	0	0	111
539	P	56.1	Low	52.2	Low	111 Å²	111	115.6 Å²	115.6	72%	0.721	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60.4	151.4	174.6	27.4	-35	0	0	0	110.9	L541	P539-L541 PolarHBondContact O-N 2.95Å
540	P	51.4	Low	53	Low	125 Å²	125	116.5 Å²	116.5	81%	0.812	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-59.3	140.4	-179.1	25.3	-34.5	0	0	0	111.2
541	L	52.2	Low	53.7	Low	166 Å²	166	119.6 Å²	119.6	87%	0.869	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-59.8	142.4	174.7	-80.7	70.6	0	0	0	109.8	P539	P539-L541 PolarHBondContact O-N 2.95Å
542	A	48.6	Very low	54.6	Low	88 Å²	88	118.8 Å²	118.8	73%	0.727	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-59.7	147.7	173.8	0	0	0	0	0	110.9
543	P	54.5	Low	55.2	Low	111 Å²	111	116 Å²	116	72%	0.721	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-54.7	146.2	178	-26.5	35.1	0	0	0	112.6	L545	P543-L545 PolarHBondContact O-N 3.4Å
544	P	51.1	Low	54.9	Low	120 Å²	120	118.4 Å²	118.4	78%	0.779	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-61.6	134.3	-179.2	25.8	-34.2	0	0	0	111.2	I546	P544-I546 PolarHBondContact O-N 2.93Å; P544-I546 VanDerWaalsContact O-N 3.13Å
545	L	48.1	Very low	54.9	Low	149 Å²	149	114.5 Å²	114.5	78%	0.78	66%	0.662	S	S	*	*			trans	-67.2	111.1	178.6	-68.2	175	0	0	0	110.4	P543 M547	P543-L545 PolarHBondContact O-N 3.4Å; L545-M547 PolarHBondContact O-N 3.09Å; L545-M547 VanDerWaalsContact O-N 3.12Å
546	I	61.5	Low	54.7	Low	111 Å²	111	112.3 Å²	112.3	57%	0.569	65%	0.647	S	S	*	*			trans	-64.3	110.9	178.3	-57.8	173.4	0	0	0	109	P544 E548 N549	P544-I546 PolarHBondContact O-N 2.93Å; P544-I546 VanDerWaalsContact O-N 3.13Å; I546-E548 HydrophobicContact CG2-CB 4.39Å; I546-E548 PolarHBondContact O-N 3.38Å; I546-E548 VanDerWaalsContact O-N 3.17Å; I546-N549 PolarHBondContact O-N 3.35Å; I546-N549 VanDerWaalsContact O-N 3.14Å
547	M	56	Low	54.6	Low	151 Å²	151	110.5 Å²	110.5	74%	0.744	64%	0.642	S	S	*	*	H	α-helix	trans	-65.1	-21.3	-169.5	-74.5	-179.8	-91.8	0	0	114.4	L545 N549 L550 K551	L545-M547 PolarHBondContact O-N 3.09Å; L545-M547 VanDerWaalsContact O-N 3.12Å; M547-N549 VanDerWaalsContact C-N 3.34Å; M547-N549 PolarHBondContact O-N 2.93Å; M547-L550 VanDerWaalsContact O-CB 3.29Å; M547-L550 WeakPolarHBondContact O-CB 3.42Å; M547-L550 PolarHBondContact O-N 3.01Å; M547-L550 VanDerWaalsContact O-N 3.14Å; M547-K551 PolarHBondContact O-N 3.49Å
548	E	56.2	Low	54.5	Low	139 Å²	139	111.4 Å²	111.4	65%	0.65	65%	0.646	S	S	*	*	H	α-helix	trans	-63.1	-38.7	173.9	-62.5	-173	108	0	0	112.6	I546 L550 K551 N552	I546-E548 HydrophobicContact CG2-CB 4.39Å; I546-E548 PolarHBondContact O-N 3.38Å; I546-E548 VanDerWaalsContact O-N 3.17Å; E548-L550 PolarHBondContact O-N 3.36Å; E548-K551 PolarHBondContact O-N 3.21Å; E548-K551 VanDerWaalsContact O-N 3.16Å; E548-N552 PolarHBondContact O-N 3.26Å; E548-N552 PolarHBondContact O-ND2 2.98Å
549	N	59.1	Low	54.4	Low	91 Å²	91	112.9 Å²	112.9	49%	0.487	64%	0.643	S	S	.	*	H	α-helix	trans	-65.1	-26.4	175.3	-74.9	-18.9	0	0	0	111.8	I546 M547 S553	I546-N549 PolarHBondContact O-N 3.35Å; I546-N549 VanDerWaalsContact O-N 3.14Å; M547-N549 VanDerWaalsContact C-N 3.34Å; M547-N549 PolarHBondContact O-N 2.93Å; N549-S553 WeakPolarHBondContact O-CB 3.34Å; N549-S553 PolarHBondContact O-N 3.13Å
550	L	52.7	Low	54.5	Low	96 Å²	96	113.9 Å²	113.9	50%	0.503	63%	0.632	S	S	.	*	H	α-helix	trans	-70.2	-47.1	172.1	-134.8	82.1	0	0	0	111.4	M547 E548 N552 S553 L554	M547-L550 VanDerWaalsContact O-CB 3.29Å; M547-L550 WeakPolarHBondContact O-CB 3.42Å; M547-L550 PolarHBondContact O-N 3.01Å; M547-L550 VanDerWaalsContact O-N 3.14Å; E548-L550 PolarHBondContact O-N 3.36Å; L550-N552 VanDerWaalsContact C-N 3.32Å; L550-N552 PolarHBondContact O-N 3.46Å; L550-S553 WeakPolarHBondContact O-CB 3.48Å; L550-S553 PolarHBondContact O-N 3.37Å; L550-S553 PolarHBondContact O-OG 3.35Å; L550-L554 PolarHBondContact O-N 3.02Å
551	K	57.3	Low	54.4	Low	161 Å²	161	118.1 Å²	118.1	70%	0.7	64%	0.638	S	S	*	*	H	α-helix	trans	-56.8	-44.9	177.6	-66	-177.2	177.9	-176.1	0	111.6	M547 E548 S553 L554	M547-K551 PolarHBondContact O-N 3.49Å; E548-K551 PolarHBondContact O-N 3.21Å; E548-K551 VanDerWaalsContact O-N 3.16Å; K551-S553 VanDerWaalsContact C-N 3.26Å; K551-S553 PolarHBondContact O-N 2.84Å; K551-L554 PolarHBondContact O-N 2.96Å
552	N	57.7	Low	54.4	Low	110 Å²	110	118.6 Å²	118.6	59%	0.588	64%	0.638	S	S	*	*	H	α-helix	trans	-69.9	-17.3	177.7	-71	-31.5	0	0	0	114.3	E548 L550 S555	E548-N552 PolarHBondContact O-N 3.26Å; E548-N552 PolarHBondContact O-ND2 2.98Å; L550-N552 VanDerWaalsContact C-N 3.32Å; L550-N552 PolarHBondContact O-N 3.46Å; N552-S555 PolarHBondContact O-OG 3.32Å
553	S	57.7	Low	54.2	Low	38 Å²	38	117.2 Å²	117.2	27%	0.266	63%	0.632	S	S	.	*	H	α-helix	trans	-84.4	-21.3	179.4	77.1	0	0	0	0	114.3	N549 L550 K551	N549-S553 WeakPolarHBondContact O-CB 3.34Å; N549-S553 PolarHBondContact O-N 3.13Å; L550-S553 WeakPolarHBondContact O-CB 3.48Å; L550-S553 PolarHBondContact O-N 3.37Å; L550-S553 PolarHBondContact O-OG 3.35Å; K551-S553 VanDerWaalsContact C-N 3.26Å; K551-S553 PolarHBondContact O-N 2.84Å
554	L	49.2	Very low	53.9	Low	141 Å²	141	120.1 Å²	120.1	74%	0.738	64%	0.641	S	S	*	*	H	α-helix	trans	-97.4	-13	-174.3	-66.7	173.4	0	0	0	113.7	L550 K551	L550-L554 PolarHBondContact O-N 3.02Å; K551-L554 PolarHBondContact O-N 2.96Å
555	S	57.2	Low	53.6	Low	35 Å²	35	122.9 Å²	122.9	25%	0.245	64%	0.641	C	S	.	*	S	Bend	trans	-72.8	132	177.4	54.8	0	0	0	0	112	N552 R560	N552-S555 PolarHBondContact O-OG 3.32Å; S555-R560 PolarHBondContact O-NH2 3.3Å; S555-R560 VanDerWaalsContact O-NH2 3.11Å
556	P	51.3	Low	53.5	Low	70 Å²	70	123.1 Å²	123.1	46%	0.455	65%	0.648	S	S	.	*			trans	-50.9	139.8	170.7	-27.8	34.8	0	0	0	111.8	T558 Q559	P556-T558 PolarHBondContact O-N 3.37Å; P556-Q559 PolarHBondContact O-N 3.41Å
557	A	56.5	Low	52.7	Low	78 Å²	78	124.9 Å²	124.9	65%	0.645	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-59.1	-23.8	-174.2	0	0	0	0	0	113.8
558	T	56.1	Low	52.3	Low	133 Å²	133	123.1 Å²	123.1	82%	0.816	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-72.5	-21.6	176	42.5	0	0	0	0	114.8	P556	P556-T558 PolarHBondContact O-N 3.37Å
559	Q	51.3	Low	52.1	Low	146 Å²	146	121.4 Å²	121.4	68%	0.682	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-94	-0.5	-177.6	-73.1	179.8	-30.7	0	0	113.7	P556 K561	P556-Q559 PolarHBondContact O-N 3.41Å; Q559-K561 PolarHBondContact O-N 3.42Å
560	R	58.7	Low	51.8	Low	132 Å²	132	125.8 Å²	125.8	50%	0.498	69%	0.685	S	S	.	*			trans	-76.5	98.3	-179.9	-62.1	-177.4	-169.3	152.9	9.1	110.1	S555 M562	S555-R560 PolarHBondContact O-NH2 3.3Å; S555-R560 VanDerWaalsContact O-NH2 3.11Å; R560-M562 PolarHBondContact O-N 3.25Å
561	K	49.8	Very low	52.1	Low	214 Å²	214	129.3 Å²	129.3	93%	0.93	70%	0.699	S	S	*	*			trans	-53.9	103.4	169.8	-105.5	177.3	176.9	170.3	0	109.5	Q559 G563	Q559-K561 PolarHBondContact O-N 3.42Å; K561-G563 PolarHBondContact O-N 2.67Å
562	M	51.9	Low	52.5	Low	176 Å²	176	128.7 Å²	128.7	87%	0.867	70%	0.696	S	S	*	*			trans	-71.1	77.6	168.8	-74.5	-77.1	-68.2	0	0	108.9	R560	R560-M562 PolarHBondContact O-N 3.25Å
563	G	45.4	Very low	53.7	Low	59 Å²	59	126 Å²	126	61%	0.608	68%	0.682	S	S	*	*			trans	-77.8	129	166.9	0	0	0	0	0	109.7	K561 K565	K561-G563 PolarHBondContact O-N 2.67Å; G563-K565 PolarHBondContact O-N 3.21Å
564	D	46.7	Very low	55	Low	172 Å²	172	127.8 Å²	127.8	92%	0.92	69%	0.694	S	S	*	*			trans	-69.7	78.5	177.7	-79.1	-46.8	0	0	0	111.6
565	K	44.7	Very low	56.9	Low	178 Å²	178	129.1 Å²	129.1	77%	0.774	69%	0.69	S	S	*	*			trans	-115	128.7	153.7	-72	-175.8	176.3	-179.7	0	107	G563 L567	G563-K565 PolarHBondContact O-N 3.21Å; K565-L567 VanDerWaalsContact C-N 3.33Å; K565-L567 PolarHBondContact O-N 2.85Å
566	V	47.1	Very low	58.4	Low	154 Å²	154	131 Å²	131	93%	0.933	70%	0.697	S	S	*	*			trans	-68	93.7	176.5	-178.8	0	0	0	0	108.3
567	L	44.1	Very low	60.3	Low	149 Å²	149	133.1 Å²	133.1	78%	0.78	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-68.1	141.6	174	-67.2	174.7	0	0	0	109.5	K565	K565-L567 VanDerWaalsContact C-N 3.33Å; K565-L567 PolarHBondContact O-N 2.85Å
568	P	47.5	Very low	62	Low	113 Å²	113	134.5 Å²	134.5	73%	0.734	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-60.5	157.6	172.1	27.5	-34.5	0	0	0	110.9	Q570	P568-Q570 PolarHBondContact O-N 3.41Å
569	A	51.3	Low	63.8	Low	103 Å²	103	131 Å²	131	85%	0.851	67%	0.673	S	S	*	*	S	Bend	trans	-51	123.6	-174.3	0	0	0	0	0	111.6	E571	A569-E571 PolarHBondContact O-N 3.03Å
570	Q	53.7	Low	65.7	Low	183 Å²	183	126 Å²	126	86%	0.855	66%	0.657	S	S	*	*			trans	-44.4	116.5	-160.9	-67.9	177	-36.4	0	0	114.5	P568 K572	P568-Q570 PolarHBondContact O-N 3.41Å; Q570-K572 PolarHBondContact O-N 3.17Å; Q570-K572 VanDerWaalsContact O-N 3.11Å
571	E	59.8	Low	67.3	Low	170 Å²	170	122 Å²	122	79%	0.794	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57	116.5	153.3	-68.2	-164.2	145.3	0	0	107.9	A569 N573	A569-E571 PolarHBondContact O-N 3.03Å; E571-N573 PolarHBondContact O-N 3.32Å
572	K	65.1	Low	69.3	Low	148 Å²	148	116.6 Å²	116.6	64%	0.643	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-61.8	128.4	-179.4	-66.9	169.2	-175.1	168.5	0	108.2	Q570 S574 Q577	Q570-K572 PolarHBondContact O-N 3.17Å; Q570-K572 VanDerWaalsContact O-N 3.11Å; K572-S574 PolarHBondContact O-N 3.32Å; K572-Q577 HydrophobicContact CB-CG 3.71Å; K572-Q577 WeakPolarHBondContact O-CG 3.49Å; K572-Q577 PolarHBondContact O-NE2 2.98Å
573	N	83	Confident	71.3	Confident	54 Å²	54	116.6 Å²	116.6	29%	0.289	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-48.3	140.6	174.6	179.3	-6.4	0	0	0	110.1	E571 R575 D576 Q577	E571-N573 PolarHBondContact O-N 3.32Å; N573-R575 PolarHBondContact O-N 3.31Å; N573-R575 VanDerWaalsContact O-N 3.12Å; N573-R575 PolarHBondContact OD1-N 3.16Å; N573-D576 HydrophobicContact CB-CB 4.38Å; N573-D576 WeakPolarHBondContact CB-OD2 3.31Å; N573-D576 CarbonylContact O-C 3.56Å; N573-D576 WeakPolarHBondContact O-CA 3.38Å; N573-D576 PolarHBondContact O-N 2.93Å; N573-Q577 PolarHBondContact O-N 2.72Å
574	S	85	Confident	73.5	Confident	75 Å²	75	117.6 Å²	117.6	52%	0.524	62%	0.62	S	S	.	*	H	α-helix	trans	-54.8	-33.9	-178.6	59.1	0	0	0	0	112.5	K572 L578	K572-S574 PolarHBondContact O-N 3.32Å; S574-L578 WeakPolarHBondContact O-CB 3.2Å; S574-L578 PolarHBondContact O-N 3.38Å
575	R	88.9	Confident	75.7	Confident	170 Å²	170	112.7 Å²	112.7	64%	0.642	60%	0.599	S	S	*	*	H	α-helix	trans	-59.6	-44.3	170	-179	-177.5	174.6	99.2	0.8	112.7	N573 L578 L579	N573-R575 PolarHBondContact O-N 3.31Å; N573-R575 VanDerWaalsContact O-N 3.12Å; N573-R575 PolarHBondContact OD1-N 3.16Å; R575-L578 PolarHBondContact O-N 3.09Å; R575-L579 HydrophobicContact CG-CD1 4.03Å; R575-L579 WeakPolarHBondContact O-CB 3.5Å; R575-L579 VanDerWaalsContact O-CG 3.26Å; R575-L579 WeakPolarHBondContact O-CG 3.4Å; R575-L579 PolarHBondContact O-N 3.42Å
576	D	89	Confident	78	Confident	75 Å²	75	108.6 Å²	108.6	40%	0.401	59%	0.585	S	S	.	*	H	α-helix	trans	-78.4	-29.2	-177.4	-64	-42	0	0	0	112.2	N573 A580	N573-D576 HydrophobicContact CB-CB 4.38Å; N573-D576 WeakPolarHBondContact CB-OD2 3.31Å; N573-D576 CarbonylContact O-C 3.56Å; N573-D576 WeakPolarHBondContact O-CA 3.38Å; N573-D576 PolarHBondContact O-N 2.93Å; D576-A580 WeakPolarHBondContact O-CB 3.19Å; D576-A580 PolarHBondContact O-N 2.87Å
577	Q	90.9	Very high	79.9	Confident	114 Å²	114	108.1 Å²	108.1	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-63.5	-47.6	165.8	-63.8	-170.9	31.5	0	0	111	K572 N573 A580 A581	K572-Q577 HydrophobicContact CB-CG 3.71Å; K572-Q577 WeakPolarHBondContact O-CG 3.49Å; K572-Q577 PolarHBondContact O-NE2 2.98Å; N573-Q577 PolarHBondContact O-N 2.72Å; Q577-A580 PolarHBondContact O-N 3.49Å; Q577-A581 WeakPolarHBondContact O-CB 3.45Å; Q577-A581 PolarHBondContact O-N 3.29Å
578	L	92.3	Very high	81.9	Confident	107 Å²	107	110.4 Å²	110.4	56%	0.56	58%	0.58	S	S	*	*	H	α-helix	trans	-61	-45.5	176.1	176.6	61.3	0	0	0	111.8	S574 R575 A580 A581 I582	S574-L578 WeakPolarHBondContact O-CB 3.2Å; S574-L578 PolarHBondContact O-N 3.38Å; R575-L578 PolarHBondContact O-N 3.09Å; L578-A580 VanDerWaalsContact C-N 3.33Å; L578-A580 PolarHBondContact O-N 2.96Å; L578-A581 PolarHBondContact O-N 3.36Å; L578-I582 HydrophobicContact CD1-CD1 3.98Å; L578-I582 HydrophobicContact CD1-CG1 4.32Å; L578-I582 HydrophobicContact CG-CD1 3.94Å; L578-I582 WeakPolarHBondContact O-CB 3.35Å; L578-I582 VanDerWaalsContact O-CG1 3.27Å; L578-I582 WeakPolarHBondContact O-CG1 3.42Å; L578-I582 PolarHBondContact O-N 2.89Å
579	L	93.4	Very high	83.8	Confident	60 Å²	60	110.9 Å²	110.9	31%	0.314	57%	0.573	S	S	.	*	H	α-helix	trans	-67.5	-31.6	176.6	-70.4	171.3	0	0	0	112.4	R575 R583	R575-L579 HydrophobicContact CG-CD1 4.03Å; R575-L579 WeakPolarHBondContact O-CB 3.5Å; R575-L579 VanDerWaalsContact O-CG 3.26Å; R575-L579 WeakPolarHBondContact O-CG 3.4Å; R575-L579 PolarHBondContact O-N 3.42Å; L579-R583 WeakPolarHBondContact O-CB 3.32Å; L579-R583 VanDerWaalsContact O-CG 3.3Å; L579-R583 WeakPolarHBondContact O-CG 3.22Å; L579-R583 PolarHBondContact O-N 3.03Å; L579-R583 PolarHBondContact O-NE 3.03Å
580	A	91.6	Very high	85.6	Confident	41 Å²	41	111.6 Å²	111.6	34%	0.339	56%	0.562	S	S	.	*	H	α-helix	trans	-68.9	-44.5	171.3	0	0	0	0	0	111.6	D576 Q577 L578 R583 S584	D576-A580 WeakPolarHBondContact O-CB 3.19Å; D576-A580 PolarHBondContact O-N 2.87Å; Q577-A580 PolarHBondContact O-N 3.49Å; L578-A580 VanDerWaalsContact C-N 3.33Å; L578-A580 PolarHBondContact O-N 2.96Å; A580-R583 PolarHBondContact O-N 3.43Å; A580-S584 PolarHBondContact O-N 2.97Å; A580-S584 PolarHBondContact O-OG 3.39Å
581	A	91.1	Very high	87.4	Confident	46 Å²	46	112 Å²	112	38%	0.38	56%	0.561	S	S	.	*	H	α-helix	trans	-56.7	-51.7	174.8	0	0	0	0	0	110.6	Q577 L578 R583 S584 S585	Q577-A581 WeakPolarHBondContact O-CB 3.45Å; Q577-A581 PolarHBondContact O-N 3.29Å; L578-A581 PolarHBondContact O-N 3.36Å; A581-R583 VanDerWaalsContact C-N 3.33Å; A581-R583 PolarHBondContact O-N 2.97Å; A581-S584 WeakPolarHBondContact CA-OG 3.32Å; A581-S584 CarbonylContact O-C 3.57Å; A581-S584 WeakPolarHBondContact O-CA 3.38Å; A581-S584 PolarHBondContact O-N 3.1Å; A581-S584 PolarHBondContact O-OG 3.08Å; A581-S585 PolarHBondContact O-N 2.89Å; A581-S585 PolarHBondContact O-OG 3.3Å
582	I	93.4	Very high	88.8	Confident	101 Å²	101	113.5 Å²	113.5	52%	0.518	56%	0.564	S	S	.	*	H	α-helix	trans	-56.8	-42.6	176.1	-68.1	164.8	0	0	0	111.9	L578 S584 S585	L578-I582 HydrophobicContact CD1-CD1 3.98Å; L578-I582 HydrophobicContact CD1-CG1 4.32Å; L578-I582 HydrophobicContact CG-CD1 3.94Å; L578-I582 WeakPolarHBondContact O-CB 3.35Å; L578-I582 VanDerWaalsContact O-CG1 3.27Å; L578-I582 WeakPolarHBondContact O-CG1 3.42Å; L578-I582 PolarHBondContact O-N 2.89Å; I582-S584 VanDerWaalsContact C-N 3.3Å; I582-S584 PolarHBondContact O-N 3.18Å; I582-S585 WeakPolarHBondContact O-CB 3.47Å; I582-S585 PolarHBondContact O-N 3.02Å; I582-S585 VanDerWaalsContact O-N 3.16Å
583	R	93.5	Very high	89.9	Confident	177 Å²	177	112 Å²	112	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-66.3	-28.2	175.2	-75.8	-177.1	-60.4	-104.1	-1	113.6	L579 A580 A581	L579-R583 WeakPolarHBondContact O-CB 3.32Å; L579-R583 VanDerWaalsContact O-CG 3.3Å; L579-R583 WeakPolarHBondContact O-CG 3.22Å; L579-R583 PolarHBondContact O-N 3.03Å; L579-R583 PolarHBondContact O-NE 3.03Å; A580-R583 PolarHBondContact O-N 3.43Å; A581-R583 VanDerWaalsContact C-N 3.33Å; A581-R583 PolarHBondContact O-N 2.97Å
584	S	90.6	Very high	90	Very high	80 Å²	80	118.3 Å²	118.3	56%	0.559	60%	0.595	S	S	*	*	H	α-helix	trans	-88.6	-5.6	173.1	63.8	0	0	0	0	114	A580 A581 I582 Q589	A580-S584 PolarHBondContact O-N 2.97Å; A580-S584 PolarHBondContact O-OG 3.39Å; A581-S584 WeakPolarHBondContact CA-OG 3.32Å; A581-S584 CarbonylContact O-C 3.57Å; A581-S584 WeakPolarHBondContact O-CA 3.38Å; A581-S584 PolarHBondContact O-N 3.1Å; A581-S584 PolarHBondContact O-OG 3.08Å; I582-S584 VanDerWaalsContact C-N 3.3Å; I582-S584 PolarHBondContact O-N 3.18Å; S584-Q589 PolarHBondContact O-NE2 3.2Å
585	S	93.6	Very high	89.8	Confident	69 Å²	69	120.6 Å²	120.6	48%	0.483	61%	0.606	S	S	.	*			trans	-79.7	146	179.3	-69.8	0	0	0	0	111.7	A581 I582 Q589	A581-S585 PolarHBondContact O-N 2.89Å; A581-S585 PolarHBondContact O-OG 3.3Å; I582-S585 WeakPolarHBondContact O-CB 3.47Å; I582-S585 PolarHBondContact O-N 3.02Å; I582-S585 VanDerWaalsContact O-N 3.16Å; S585-Q589 VanDerWaalsContact CA-OE1 3.26Å
586	N	92.6	Very high	89.3	Confident	91 Å²	91	116.9 Å²	116.9	49%	0.487	60%	0.604	S	S	.	*			trans	-145.9	152.3	177.6	-168.5	-86	0	0	0	110.8	K588 Q589	N586-K588 PolarHBondContact O-N 3.35Å; N586-K588 WeakPolarHBondContact OD1-CB 3.5Å; N586-K588 WeakPolarHBondContact OD1-CG 3.3Å; N586-K588 PolarHBondContact OD1-N 2.83Å; N586-Q589 WeakPolarHBondContact O-CB 3.46Å; N586-Q589 PolarHBondContact O-N 2.8Å
587	L	87.1	Confident	88.8	Confident	145 Å²	145	123.3 Å²	123.3	76%	0.759	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-52.2	-31	176.5	-162.8	75.6	0	0	0	112.7	Q589 L590	L587-Q589 PolarHBondContact O-N 3.35Å; L587-L590 HydrophobicContact CD1-CD1 4.05Å; L587-L590 PolarHBondContact O-N 3.17Å; L587-L590 VanDerWaalsContact O-N 3.12Å
588	K	87.3	Confident	87.9	Confident	196 Å²	196	125 Å²	125	85%	0.852	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-61.5	-18.1	175	-67.9	176.6	-178.8	-179	0	115	N586	N586-K588 PolarHBondContact O-N 3.35Å; N586-K588 WeakPolarHBondContact OD1-CB 3.5Å; N586-K588 WeakPolarHBondContact OD1-CG 3.3Å; N586-K588 PolarHBondContact OD1-N 2.83Å
589	Q	87.5	Confident	86.6	Confident	124 Å²	124	127.8 Å²	127.8	58%	0.579	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-89.9	-14.1	177.2	-62.9	164.5	-3.6	0	0	112.5	S584 S585 N586 L587	S584-Q589 PolarHBondContact O-NE2 3.2Å; S585-Q589 VanDerWaalsContact CA-OE1 3.26Å; N586-Q589 WeakPolarHBondContact O-CB 3.46Å; N586-Q589 PolarHBondContact O-N 2.8Å; L587-Q589 PolarHBondContact O-N 3.35Å
590	L	88.2	Confident	84.7	Confident	118 Å²	118	137.8 Å²	137.8	62%	0.618	70%	0.7	S	S	*	*	S	Bend	trans	-78	143.5	173.6	-56.5	-173.1	0	0	0	109.8	L587 K592	L587-L590 HydrophobicContact CD1-CD1 4.05Å; L587-L590 PolarHBondContact O-N 3.17Å; L587-L590 VanDerWaalsContact O-N 3.12Å; L590-K592 PolarHBondContact O-N 3.35Å
591	K	91.6	Very high	84.4	Confident	191 Å²	191	142.7 Å²	142.7	83%	0.83	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-60.6	120.5	170.7	-176	179.5	-179.9	-177.4	0	108.6	V593	K591-V593 PolarHBondContact O-N 3.43Å
592	K	89.1	Confident	84	Confident	201 Å²	201	147.7 Å²	147.7	87%	0.874	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58.5	130.8	172.2	-70.7	-174.6	178	-177.4	0	109.5	L590	L590-K592 PolarHBondContact O-N 3.35Å
593	V	89.2	Confident	83.5	Confident	116 Å²	116	150.3 Å²	150.3	70%	0.703	75%	0.748	S	S	*	*			trans	-127.3	131.5	169.3	179.6	0	0	0	0	106	K591	K591-V593 PolarHBondContact O-N 3.43Å
594	E	84.7	Confident	82.9	Confident	187 Å²	187	148.8 Å²	148.8	87%	0.874	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-77.9	124.4	176	-62.6	-172.8	163.2	0	0	108.8
595	V	80.1	Confident	82.4	Confident	123 Å²	123	153.1 Å²	153.1	75%	0.745	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-93.6	119.7	178	-178	0	0	0	0	107.9	K597	V595-K597 PolarHBondContact O-N 3.17Å
596	P	79.4	Confident	81.7	Confident	92 Å²	92	158.7 Å²	158.7	60%	0.597	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-56.6	130.1	172.9	-24.1	34.7	0	0	0	110.3	L598	P596-L598 WeakPolarHBondContact CB-O 3.48Å; P596-L598 PolarHBondContact O-N 2.62Å
597	K	76.8	Confident	80.9	Confident	210 Å²	210	163.5 Å²	163.5	91%	0.913	80%	0.804	S	S	*	*	S	Bend	trans	-66.3	-23.5	-178.5	-69.5	-175.1	177.5	-179.4	0	113.1	V595	V595-K597 PolarHBondContact O-N 3.17Å
598	L	72.9	Confident	80.5	Confident	149 Å²	149	164.9 Å²	164.9	78%	0.78	81%	0.808	S	S	*	*	S	Bend	trans	-142.4	148.7	168.1	-67.9	173.6	0	0	0	107.8	P596	P596-L598 WeakPolarHBondContact CB-O 3.48Å; P596-L598 PolarHBondContact O-N 2.62Å
599	L	64.1	Low	79.9	Confident	166 Å²	166	162.3 Å²	162.3	87%	0.869	80%	0.804	S	S	*	*			trans	-81.1	139.7	152.1	-73.7	158.4	0	0	0	107.1
600	Q	55	Low	79.2	Confident	271 Å²	271	165.8 Å²	165.8	100%	1.266	83%	0.825	S	S	*	*			trans	-85.8	0	169.1	-73.7	-173	-41.7	0	0	110.3

Retrieved 600 of 600 residues in 1591.4 ms (Link to these results)

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