A0A087XHE8_POEFO Loading...

MYB proto-onco like 1

AlphaFold DB , UniProt , Accession A0A087XHE8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 745 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	32.8	Very low	34.3	Very low	225 Å²	225	150.2 Å²	150.2	100%	1.108	82%	0.819	S	S	*	*				0	153.2	0	-86.4	91.7	167.3	0	0	109.4
2	D	34.9	Very low	34.3	Very low	148 Å²	148	149 Å²	149	79%	0.791	81%	0.81	S	S	*	*			trans	62.9	84.6	148.6	-50.7	-22.7	0	0	0	121.5
3	N	33.9	Very low	34.3	Very low	163 Å²	163	146.8 Å²	146.8	87%	0.872	80%	0.797	S	S	*	*				99.8	149.9	109.7	-142.6	-2.2	0	0	0	119.7
4	A	39.9	Very low	34.7	Very low	79 Å²	79	148.2 Å²	148.2	65%	0.653	80%	0.796	S	S	*	*			trans	-79.7	-177.1	-173.2	0	0	0	0	0	111.7
5	K	37.5	Very low	34.8	Very low	181 Å²	181	147.7 Å²	147.7	79%	0.787	79%	0.793	S	S	*	*			cis	-173.6	150	41.3	-157.9	174.3	176.2	172.2	0	114.8
6	T	36.5	Very low	35.2	Very low	112 Å²	112	148.7 Å²	148.7	69%	0.687	79%	0.791	S	S	*	*			trans	72.7	140.5	151.5	29.1	0	0	0	0	123.3
7	R	32.3	Very low	35.6	Very low	238 Å²	238	150.1 Å²	150.1	90%	0.898	79%	0.792	S	S	*	*			trans	77.5	102.3	147	-79.4	-179.7	169.8	172	-3.4	119.9
8	S	32.1	Very low	35.7	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	80%	0.796	S	S	*	*			trans	-145.7	140.8	130.8	-75.1	0	0	0	0	108.7
9	I	31.9	Very low	35.8	Very low	176 Å²	176	152.4 Å²	152.4	90%	0.903	80%	0.798	S	S	*	*			trans	-142.8	131	167.8	-63.5	-179	0	0	0	106
10	S	31.7	Very low	35.6	Very low	100 Å²	100	150.8 Å²	150.8	70%	0.699	80%	0.8	S	S	*	*			trans	-163.5	134.4	-179.1	52.9	0	0	0	0	110.1
11	S	33.3	Very low	35.7	Very low	111 Å²	111	149.3 Å²	149.3	78%	0.776	80%	0.797	S	S	*	*			trans	65	157.5	167.5	-75.7	0	0	0	0	116.9
12	L	35.3	Very low	36	Very low	136 Å²	136	144.7 Å²	144.7	71%	0.712	78%	0.776	S	S	*	*			cis	-166.2	-179.8	-29.7	-119.5	176.7	0	0	0	107.3
13	D	33.7	Very low	36.5	Very low	120 Å²	120	143.1 Å²	143.1	64%	0.642	77%	0.774	S	S	*	*			trans	71	128.8	163.1	-44.7	-31.7	0	0	0	115.1
14	E	40.1	Very low	37	Very low	167 Å²	167	141.4 Å²	141.4	78%	0.78	76%	0.761	S	S	*	*				67.4	125.9	67	-62.9	176.1	179.2	0	0	111.5
15	D	36.7	Very low	37.4	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	76%	0.759	S	S	*	*			cis	-159.5	-159	5.1	-112.7	-26.7	0	0	0	111.5
16	E	40.9	Very low	37.6	Very low	163 Å²	163	141.6 Å²	141.6	76%	0.762	76%	0.758	S	S	*	*			trans	96.1	99.4	158.5	-59.7	-57.8	151.3	0	0	122.6
17	E	42.3	Very low	38	Very low	172 Å²	172	143.3 Å²	143.3	80%	0.804	76%	0.759	S	S	*	*			trans	22.8	118.8	131.3	-170.7	165.8	-108.7	0	0	122.4
18	L	37.6	Very low	38.6	Very low	166 Å²	166	136.9 Å²	136.9	87%	0.869	74%	0.737	S	S	*	*				-165.5	107.6	124.6	-120	160.9	0	0	0	112.9
19	H	36.7	Very low	39.2	Very low	179 Å²	179	135.2 Å²	135.2	83%	0.829	73%	0.726	S	S	*	*			trans	-93	120.7	171.5	-95.1	-62.2	0	0	0	111.6
20	S	31.3	Very low	39.8	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	72%	0.715	S	S	*	*			trans	-113.3	116.6	162.3	-173.8	0	0	0	0	109.2
21	T	38.5	Very low	40.7	Very low	120 Å²	120	133.3 Å²	133.3	74%	0.736	70%	0.702	S	S	*	*			trans	-110.8	100.3	-175	55.2	0	0	0	0	111.7
22	D	39.7	Very low	41.6	Very low	128 Å²	128	134.5 Å²	134.5	68%	0.684	69%	0.693	S	S	*	*			trans	-66.4	127.2	173.2	-174.2	-20.4	0	0	0	111.5	E24	D22-E24 VanDerWaalsContact C-N 3.29Å; D22-E24 PolarHBondContact O-N 2.93Å; D22-E24 PolarHBondContact OD1-N 2.82Å
23	P	45.7	Very low	42.4	Very low	116 Å²	116	136.3 Å²	136.3	75%	0.753	70%	0.695	S	S	*	*	S	Bend	trans	-76.4	7.4	-174	30.4	-36	0	0	0	116.7	S25	P23-S25 PolarHBondContact O-N 3.02Å
24	E	44.5	Very low	43.4	Very low	126 Å²	126	136.4 Å²	136.4	59%	0.589	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	24.4	-172.5	-145.4	-158.8	82.3	0	0	116.8	D22 K28	D22-E24 VanDerWaalsContact C-N 3.29Å; D22-E24 PolarHBondContact O-N 2.93Å; D22-E24 PolarHBondContact OD1-N 2.82Å; E24-K28 PolarHBondContact O-NZ 2.71Å; E24-K28 IonicContact OE1-NZ 3.03Å; E24-K28 PolarHBondContact OE1-NZ 3.07Å
25	S	47.1	Very low	44.1	Very low	88 Å²	88	131.8 Å²	131.8	62%	0.615	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-21.7	-174.6	60.8	0	0	0	0	115.4	P23	P23-S25 PolarHBondContact O-N 3.02Å
26	K	42.4	Very low	44.9	Very low	176 Å²	176	129.1 Å²	129.1	77%	0.765	67%	0.667	S	S	*	*	S	Bend	trans	-86	-24.7	-166.8	-74.9	-178.6	177.6	174	0	116.1
27	E	43.9	Very low	45.7	Very low	149 Å²	149	130.1 Å²	130.1	70%	0.696	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-68.4	-44.7	-179.9	-65.5	-153.5	114.7	0	0	112.4	S29 K30	E27-S29 PolarHBondContact O-N 3.29Å; E27-K30 PolarHBondContact O-N 2.69Å
28	K	45.2	Very low	47.3	Very low	102 Å²	102	126.1 Å²	126.1	44%	0.443	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-55.9	-1.2	-177.8	-66	155.7	-174.8	149.4	0	115.3	E24 K32	E24-K28 PolarHBondContact O-NZ 2.71Å; E24-K28 IonicContact OE1-NZ 3.03Å; E24-K28 PolarHBondContact OE1-NZ 3.07Å; K28-K32 WeakPolarHBondContact O-CD 3.31Å; K28-K32 WeakPolarHBondContact O-CE 3.41Å; K28-K32 WeakPolarHBondContact O-CG 3.45Å; K28-K32 PolarHBondContact O-NZ 2.93Å
29	S	43.9	Very low	49.6	Very low	85 Å²	85	127.2 Å²	127.2	59%	0.594	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-94.6	-29.3	170.8	-171.6	0	0	0	0	113.8	E27	E27-S29 PolarHBondContact O-N 3.29Å
30	K	44.7	Very low	52.2	Low	157 Å²	157	120.5 Å²	120.5	68%	0.683	62%	0.621	S	S	*	*	H	α-helix	trans	-75.6	-43.4	180	-68.7	177.2	-178	171.2	0	110.5	E27 K32 K33 L34	E27-K30 PolarHBondContact O-N 2.69Å; K30-K32 PolarHBondContact O-N 3.46Å; K30-K33 WeakPolarHBondContact O-CA 3.4Å; K30-K33 VanDerWaalsContact O-CB 3.27Å; K30-K33 WeakPolarHBondContact O-CB 3.32Å; K30-K33 PolarHBondContact O-N 2.98Å; K30-L34 PolarHBondContact O-N 2.7Å
31	D	50.4	Low	55.1	Low	78 Å²	78	116.8 Å²	116.8	42%	0.417	60%	0.595	S	S	.	*	H	α-helix	trans	-62.3	-43.9	-178.2	-47.2	-52.7	0	0	0	111.9	K33 L34 L35	D31-K33 PolarHBondContact O-N 2.71Å; D31-L34 WeakPolarHBondContact O-CA 3.44Å; D31-L34 PolarHBondContact O-N 2.69Å; D31-L35 HydrophobicContact CB-CD1 4.37Å; D31-L35 WeakPolarHBondContact O-CB 3.41Å; D31-L35 WeakPolarHBondContact O-CD1 3.38Å; D31-L35 PolarHBondContact O-N 2.96Å
32	K	53.6	Low	57.7	Low	137 Å²	137	119.8 Å²	119.8	60%	0.596	59%	0.593	S	S	*	*	H	α-helix	trans	-51.8	-31.3	173.8	-69.9	173.5	-173.1	162.1	0	112.7	K28 K30 C36	K28-K32 WeakPolarHBondContact O-CD 3.31Å; K28-K32 WeakPolarHBondContact O-CE 3.41Å; K28-K32 WeakPolarHBondContact O-CG 3.45Å; K28-K32 PolarHBondContact O-NZ 2.93Å; K30-K32 PolarHBondContact O-N 3.46Å; K32-C36 PolarHBondContact O-SG 3.22Å
33	K	52.7	Low	60.2	Low	174 Å²	174	119 Å²	119	76%	0.757	59%	0.589	S	S	*	*	H	α-helix	trans	-81.5	-23.7	179.6	-148.7	170.7	-172.9	174.4	0	113	K30 D31	K30-K33 WeakPolarHBondContact O-CA 3.4Å; K30-K33 VanDerWaalsContact O-CB 3.27Å; K30-K33 WeakPolarHBondContact O-CB 3.32Å; K30-K33 PolarHBondContact O-N 2.98Å; D31-K33 PolarHBondContact O-N 2.71Å
34	L	53.3	Low	62.4	Low	121 Å²	121	115.2 Å²	115.2	63%	0.634	56%	0.561	S	S	*	*	H	α-helix	trans	-86.4	-44.8	173.8	-66	174.1	0	0	0	111.9	K30 D31 C36 K37	K30-L34 PolarHBondContact O-N 2.7Å; D31-L34 WeakPolarHBondContact O-CA 3.44Å; D31-L34 PolarHBondContact O-N 2.69Å; L34-C36 PolarHBondContact O-N 2.79Å; L34-K37 PolarHBondContact O-N 3.36Å
35	L	54.3	Low	64.8	Low	70 Å²	70	110.5 Å²	110.5	37%	0.366	54%	0.54	S	S	.	.	H	α-helix	trans	-47.3	-44.8	173	-95.8	57.4	0	0	0	112.1	D31 K37 V38 G69	D31-L35 HydrophobicContact CB-CD1 4.37Å; D31-L35 WeakPolarHBondContact O-CB 3.41Å; D31-L35 WeakPolarHBondContact O-CD1 3.38Å; D31-L35 PolarHBondContact O-N 2.96Å; L35-K37 PolarHBondContact O-N 2.83Å; L35-K37 VanDerWaalsContact O-N 3.09Å; L35-V38 PolarHBondContact O-N 2.78Å; L35-G69 WeakPolarHBondContact CB-O 3.07Å; L35-G69 WeakPolarHBondContact CG-O 3.16Å
36	C	54.3	Low	67.1	Low	86 Å²	86	111.1 Å²	111.1	58%	0.581	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.4	178.6	-69.2	0	0	0	0	115.3	K32 L34 Q74	K32-C36 PolarHBondContact O-SG 3.22Å; L34-C36 PolarHBondContact O-N 2.79Å; C36-Q74 PolarHBondContact SG-NE2 3.24Å
37	K	58.8	Low	69.5	Low	184 Å²	184	107.4 Å²	107.4	80%	0.8	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-6.6	-173.3	-154.8	165.5	-176.3	179.4	0	114.2	L34 L35 K39	L34-K37 PolarHBondContact O-N 3.36Å; L35-K37 PolarHBondContact O-N 2.83Å; L35-K37 VanDerWaalsContact O-N 3.09Å; K37-K39 PolarHBondContact O-N 3.04Å
38	V	75.4	Confident	71.8	Confident	87 Å²	87	100.3 Å²	100.3	53%	0.527	48%	0.483	S	S	.	.	S	Bend	trans	-63.9	123.3	171.9	-175	0	0	0	0	108.8	L35 R70	L35-V38 PolarHBondContact O-N 2.78Å; V38-R70 PolarHBondContact O-NH1 2.86Å; V38-R70 PolarHBondContact O-NH2 3.05Å
39	K	85.9	Confident	74.1	Confident	189 Å²	189	99.6 Å²	99.6	82%	0.822	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-63.6	137.6	174.6	-175.8	-177.7	174.9	-171.6	0	109	K37 S41 R70	K37-K39 PolarHBondContact O-N 3.04Å; K39-S41 PolarHBondContact O-N 3.37Å; K39-R70 PolarHBondContact O-NH2 3.09Å
40	W	90.9	Very high	76.5	Confident	39 Å²	39	101.7 Å²	101.7	15%	0.148	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-61.3	126.2	173.3	-77.7	80	0	0	0	110.2	E44 L48 F67 R70 Q74 R78	W40-E44 WeakPolarHBondContact CA-OE2 3.43Å; W40-E44 HydrophobicContact CE3-CB 3.74Å; W40-E44 HydrophobicContact CZ3-CB 4.07Å; W40-L48 HydrophobicContact CE3-CD2 4.47Å; W40-L48 HydrophobicContact CH2-CD2 3.76Å; W40-L48 HydrophobicContact CZ3-CB 4.43Å; W40-L48 HydrophobicContact CZ3-CD2 3.63Å; W40-F67 HydrophobicContact CZ3-CD1 4.46Å; W40-F67 HydrophobicContact CZ3-CE1 4.41Å; W40-R70 HydrophobicContact CH2-CG 4.2Å; W40-R70 HydrophobicContact CZ2-CG 4.34Å; W40-Q74 HydrophobicContact CZ2-CB 4.24Å; W40-R78 VanDerWaalsContact CB-CZ 3.5Å; W40-R78 HydrophobicContact CD2-CB 4.29Å; W40-R78 HydrophobicContact CD2-CG 3.66Å; W40-R78 HydrophobicContact CE3-CG 3.82Å; W40-R78 HydrophobicContact CG-CG 4.21Å; W40-R78 HydrophobicContact CH2-CB 4.14Å; W40-R78 HydrophobicContact CH2-CG 4.24Å; W40-R78 HydrophobicContact CZ2-CB 3.77Å; W40-R78 HydrophobicContact CZ2-CG 4.06Å; W40-R78 HydrophobicContact CZ3-CG 4.12Å
41	S	92.3	Very high	78.8	Confident	41 Å²	41	94.7 Å²	94.7	29%	0.287	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-77.5	165.4	172.2	99.3	0	0	0	0	111.2	K39 D43 E44 D45	K39-S41 PolarHBondContact O-N 3.37Å; S41-D43 VanDerWaalsContact C-N 3.31Å; S41-D43 WeakPolarHBondContact CB-OD2 3.18Å; S41-D43 PolarHBondContact OG-N 2.79Å; S41-D43 VanDerWaalsContact OG-N 3.13Å; S41-D43 PolarHBondContact OG-OD2 2.75Å; S41-E44 PolarHBondContact N-OE2 2.76Å; S41-E44 PolarHBondContact OG-N 3.47Å; S41-D45 PolarHBondContact O-N 2.88Å; S41-D45 VanDerWaalsContact O-N 3.11Å
42	R	92.1	Very high	80.8	Confident	182 Å²	182	91.3 Å²	91.3	69%	0.687	43%	0.431	S	S	*	.	H	α-helix	trans	-64	-40.7	173.3	179.2	177.9	171.7	-169.8	-11.5	110.9	D45 E46	R42-D45 WeakPolarHBondContact O-CB 3.42Å; R42-D45 PolarHBondContact O-N 2.9Å; R42-E46 HydrophobicContact CG-CG 4.47Å; R42-E46 IonicContact CZ-OE1 2.79Å; R42-E46 IonicContact NE-OE1 3.95Å; R42-E46 PolarHBondContact NE-OE1 3.29Å; R42-E46 IonicContact NH2-OE1 2.71Å; R42-E46 PolarHBondContact NH2-OE1 2.72Å; R42-E46 WeakPolarHBondContact O-CG 3.14Å; R42-E46 PolarHBondContact O-N 3.18Å
43	D	92.6	Very high	82.5	Confident	112 Å²	112	91.3 Å²	91.3	60%	0.599	43%	0.433	S	S	*	.	H	α-helix	trans	-71	-35.7	-177.9	-19.7	-80.1	0	0	0	110.7	S41 K47	S41-D43 VanDerWaalsContact C-N 3.31Å; S41-D43 WeakPolarHBondContact CB-OD2 3.18Å; S41-D43 PolarHBondContact OG-N 2.79Å; S41-D43 VanDerWaalsContact OG-N 3.13Å; S41-D43 PolarHBondContact OG-OD2 2.75Å; D43-K47 WeakPolarHBondContact O-CB 3.43Å; D43-K47 PolarHBondContact O-N 2.74Å
44	E	92.9	Very high	84.3	Confident	36 Å²	36	88.8 Å²	88.8	17%	0.168	42%	0.424	C	S	.	.	H	α-helix	trans	-62.2	-43.4	168.5	-72.3	-176.5	110	0	0	111.8	W40 S41 L48 F67 R70	W40-E44 WeakPolarHBondContact CA-OE2 3.43Å; W40-E44 HydrophobicContact CE3-CB 3.74Å; W40-E44 HydrophobicContact CZ3-CB 4.07Å; S41-E44 PolarHBondContact N-OE2 2.76Å; S41-E44 PolarHBondContact OG-N 3.47Å; E44-L48 WeakPolarHBondContact O-CB 3.47Å; E44-L48 PolarHBondContact O-N 2.85Å; E44-F67 HydrophobicContact CB-CD1 4.49Å; E44-F67 HydrophobicContact CB-CE1 4.21Å; E44-F67 HydrophobicContact CG-CD1 4.4Å; E44-F67 WeakPolarHBondContact O-CE1 3.05Å; E44-R70 VanDerWaalsContact CD-NH2 3.29Å; E44-R70 IonicContact OE1-CZ 3.19Å; E44-R70 VanDerWaalsContact OE1-CZ 3.3Å; E44-R70 IonicContact OE1-NE 3.77Å; E44-R70 PolarHBondContact OE1-NE 3.39Å; E44-R70 IonicContact OE1-NH2 3.2Å; E44-R70 PolarHBondContact OE1-NH2 3.14Å; E44-R70 IonicContact OE2-CZ 3.62Å; E44-R70 IonicContact OE2-NE 2.91Å; E44-R70 IonicContact OE2-NH2 3.35Å; E44-R70 PolarHBondContact OE2-NH2 2.89Å
45	D	94.2	Very high	85.9	Confident	28 Å²	28	87 Å²	87	15%	0.15	41%	0.413	C	S	.	.	H	α-helix	trans	-65.9	-43.9	177.9	-77.4	-21.5	0	0	0	112.3	S41 R42 L48 K49 R78 L83	S41-D45 PolarHBondContact O-N 2.88Å; S41-D45 VanDerWaalsContact O-N 3.11Å; R42-D45 WeakPolarHBondContact O-CB 3.42Å; R42-D45 PolarHBondContact O-N 2.9Å; D45-L48 PolarHBondContact O-N 2.88Å; D45-K49 PolarHBondContact O-N 3.11Å; D45-R78 VanDerWaalsContact CG-NH2 3.31Å; D45-R78 IonicContact OD1-CZ 3.51Å; D45-R78 IonicContact OD1-NE 3.96Å; D45-R78 PolarHBondContact OD1-NE 3.37Å; D45-R78 IonicContact OD1-NH2 3.51Å; D45-R78 PolarHBondContact OD1-NH2 3.32Å; D45-R78 VanDerWaalsContact OD1-NH2 3.13Å; D45-R78 IonicContact OD2-CZ 2.75Å; D45-R78 IonicContact OD2-NE 3.43Å; D45-R78 IonicContact OD2-NH2 2.68Å; D45-R78 PolarHBondContact OD2-NH2 2.72Å; D45-L83 HydrophobicContact CB-CD1 3.9Å; D45-L83 HydrophobicContact CB-CD2 3.79Å; D45-L83 HydrophobicContact CB-CG 4.48Å
46	E	94.3	Very high	87.5	Confident	101 Å²	101	85.4 Å²	85.4	47%	0.472	41%	0.412	S	S	.	.	H	α-helix	trans	-68.4	-40.9	178.5	-73.3	-179.1	-173.7	0	0	111.5	R42 L48 K49 K50	R42-E46 HydrophobicContact CG-CG 4.47Å; R42-E46 IonicContact CZ-OE1 2.79Å; R42-E46 IonicContact NE-OE1 3.95Å; R42-E46 PolarHBondContact NE-OE1 3.29Å; R42-E46 IonicContact NH2-OE1 2.71Å; R42-E46 PolarHBondContact NH2-OE1 2.72Å; R42-E46 WeakPolarHBondContact O-CG 3.14Å; R42-E46 PolarHBondContact O-N 3.18Å; E46-L48 VanDerWaalsContact C-N 3.32Å; E46-L48 PolarHBondContact O-N 2.87Å; E46-K49 PolarHBondContact O-N 3.27Å; E46-K50 PolarHBondContact O-N 3.18Å
47	K	93	Very high	88.9	Confident	97 Å²	97	85 Å²	85	42%	0.422	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-40.2	171.1	-169.3	-177.3	-167	-174.5	0	111.4	D43 K50 L51 F66 F67	D43-K47 WeakPolarHBondContact O-CB 3.43Å; D43-K47 PolarHBondContact O-N 2.74Å; K47-K50 PolarHBondContact O-N 2.79Å; K47-L51 HydrophobicContact CG-CD1 3.97Å; K47-L51 WeakPolarHBondContact O-CB 3.33Å; K47-L51 WeakPolarHBondContact O-CG 3.43Å; K47-L51 PolarHBondContact O-N 3.37Å; K47-F66 PolarHBondContact NZ-O 3.19Å; K47-F67 HydrophobicContact CB-CE1 4.11Å; K47-F67 HydrophobicContact CB-CZ 4.03Å; K47-F67 HydrophobicContact CD-CE1 3.95Å; K47-F67 HydrophobicContact CD-CZ 4.08Å; K47-F67 HydrophobicContact CG-CE1 4.2Å; K47-F67 HydrophobicContact CG-CZ 3.94Å
48	L	93.5	Very high	90.1	Very high	0 Å²	0	84.6 Å²	84.6	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-68.6	-39.6	179.2	178.8	57.1	0	0	0	111	W40 E44 D45 E46 L51 V52 W60 I63 F67 C75 R78 L83	W40-L48 HydrophobicContact CE3-CD2 4.47Å; W40-L48 HydrophobicContact CH2-CD2 3.76Å; W40-L48 HydrophobicContact CZ3-CB 4.43Å; W40-L48 HydrophobicContact CZ3-CD2 3.63Å; E44-L48 WeakPolarHBondContact O-CB 3.47Å; E44-L48 PolarHBondContact O-N 2.85Å; D45-L48 PolarHBondContact O-N 2.88Å; E46-L48 VanDerWaalsContact C-N 3.32Å; E46-L48 PolarHBondContact O-N 2.87Å; L48-L51 PolarHBondContact O-N 3.41Å; L48-V52 HydrophobicContact CD1-CG2 4.04Å; L48-V52 VanDerWaalsContact O-CG2 3.32Å; L48-V52 WeakPolarHBondContact O-CG2 3.35Å; L48-V52 PolarHBondContact O-N 3.21Å; L48-W60 HydrophobicContact CD1-CZ3 4.41Å; L48-I63 HydrophobicContact CD1-CG2 3.59Å; L48-F67 HydrophobicContact CB-CE1 4.34Å; L48-F67 HydrophobicContact CB-CE2 4.29Å; L48-F67 HydrophobicContact CB-CZ 3.68Å; L48-F67 HydrophobicContact CD1-CE2 4.05Å; L48-F67 HydrophobicContact CD1-CZ 4.31Å; L48-C75 HydrophobicContact CD1-CB 3.93Å; L48-C75 HydrophobicContact CD2-CB 4.48Å; L48-R78 HydrophobicContact CD2-CB 3.8Å; L48-R78 HydrophobicContact CD2-CG 3.78Å; L48-L83 HydrophobicContact CB-CD1 4.09Å; L48-L83 HydrophobicContact CD2-CD1 3.75Å; L48-L83 HydrophobicContact CG-CD1 4.02Å
49	K	93.6	Very high	90.7	Very high	87 Å²	87	83 Å²	83	38%	0.378	40%	0.401	S	S	.	.	H	α-helix	trans	-57.5	-53.9	171.1	-175.1	-172.8	178.2	-82	0	110.7	D45 E46 L51 V52 E53 W79	D45-K49 PolarHBondContact O-N 3.11Å; E46-K49 PolarHBondContact O-N 3.27Å; K49-L51 VanDerWaalsContact C-N 3.32Å; K49-L51 PolarHBondContact O-N 3.47Å; K49-V52 PolarHBondContact O-N 3.25Å; K49-E53 IonicContact NZ-OE1 2.7Å; K49-E53 PolarHBondContact NZ-OE1 3.37Å; K49-E53 IonicContact NZ-OE2 3.7Å; K49-E53 PolarHBondContact NZ-OE2 3.43Å; K49-E53 VanDerWaalsContact O-CB 3.25Å; K49-E53 WeakPolarHBondContact O-CB 3.34Å; K49-E53 PolarHBondContact O-N 2.7Å; K49-W79 HydrophobicContact CB-CZ3 4.18Å; K49-W79 HydrophobicContact CG-CH2 4.37Å; K49-W79 HydrophobicContact CG-CZ3 4.09Å
50	K	93	Very high	91	Very high	129 Å²	129	75 Å²	75	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-59.4	-40.5	-178.5	-172.3	173	-178.1	175.2	0	112.4	E46 K47 E53 Q54	E46-K50 PolarHBondContact O-N 3.18Å; K47-K50 PolarHBondContact O-N 2.79Å; K50-E53 PolarHBondContact O-N 3.37Å; K50-Q54 WeakPolarHBondContact O-CB 3.17Å; K50-Q54 VanDerWaalsContact O-CG 3.24Å; K50-Q54 WeakPolarHBondContact O-CG 3.48Å; K50-Q54 PolarHBondContact O-N 2.88Å
51	L	92.9	Very high	91	Very high	10 Å²	10	80.7 Å²	80.7	5%	0.052	39%	0.391	C	S	.	.	H	α-helix	trans	-71.1	-34.3	178.9	-73.4	167.5	0	0	0	113.4	K47 L48 K49 Q54 H55 I63 F66 F67	K47-L51 HydrophobicContact CG-CD1 3.97Å; K47-L51 WeakPolarHBondContact O-CB 3.33Å; K47-L51 WeakPolarHBondContact O-CG 3.43Å; K47-L51 PolarHBondContact O-N 3.37Å; L48-L51 PolarHBondContact O-N 3.41Å; K49-L51 VanDerWaalsContact C-N 3.32Å; K49-L51 PolarHBondContact O-N 3.47Å; L51-Q54 PolarHBondContact O-N 2.78Å; L51-H55 WeakPolarHBondContact O-CB 3.45Å; L51-H55 PolarHBondContact O-CD2 3.3Å; L51-H55 PolarHBondContact O-N 3.36Å; L51-I63 HydrophobicContact CB-CG1 4.33Å; L51-I63 HydrophobicContact CB-CG2 4.08Å; L51-I63 HydrophobicContact CD1-CG2 4.42Å; L51-F66 HydrophobicContact CD1-CB 3.5Å; L51-F66 HydrophobicContact CD1-CD2 3.74Å; L51-F66 HydrophobicContact CD1-CG 3.72Å; L51-F66 HydrophobicContact CD2-CD2 3.7Å; L51-F66 HydrophobicContact CD2-CE2 3.78Å; L51-F66 HydrophobicContact CD2-CG 4.09Å; L51-F66 HydrophobicContact CD2-CZ 4.23Å; L51-F66 HydrophobicContact CG-CD2 4.38Å; L51-F67 HydrophobicContact CD1-CE2 3.62Å; L51-F67 HydrophobicContact CD1-CZ 3.94Å
52	V	92.6	Very high	90.9	Very high	8 Å²	8	81.5 Å²	81.5	5%	0.048	40%	0.397	C	S	.	.	H	α-helix	trans	-73.6	-32.9	172.7	177.9	0	0	0	0	111.3	L48 K49 Q54 G56 T57 W60 I63 W79	L48-V52 HydrophobicContact CD1-CG2 4.04Å; L48-V52 VanDerWaalsContact O-CG2 3.32Å; L48-V52 WeakPolarHBondContact O-CG2 3.35Å; L48-V52 PolarHBondContact O-N 3.21Å; K49-V52 PolarHBondContact O-N 3.25Å; V52-Q54 VanDerWaalsContact C-N 3.29Å; V52-Q54 PolarHBondContact O-N 3.18Å; V52-G56 CarbonylContact O-C 3.5Å; V52-G56 WeakPolarHBondContact O-CA 3.24Å; V52-G56 PolarHBondContact O-N 3.28Å; V52-T57 HydrophobicContact CG1-CG2 3.66Å; V52-W60 HydrophobicContact CG1-CH2 4.37Å; V52-W60 HydrophobicContact CG2-CH2 3.63Å; V52-W60 HydrophobicContact CG2-CZ3 3.6Å; V52-I63 HydrophobicContact CG2-CD1 3.8Å; V52-W79 HydrophobicContact CB-CD2 4.18Å; V52-W79 HydrophobicContact CB-CE3 4.16Å; V52-W79 HydrophobicContact CB-CH2 4.23Å; V52-W79 HydrophobicContact CB-CZ2 4.23Å; V52-W79 HydrophobicContact CB-CZ3 4.23Å; V52-W79 HydrophobicContact CG1-CD2 3.88Å; V52-W79 VanDerWaalsContact CG1-CE2 3.49Å; V52-W79 HydrophobicContact CG1-CE3 4.31Å; V52-W79 HydrophobicContact CG1-CG 4.42Å; V52-W79 HydrophobicContact CG1-CH2 4.06Å; V52-W79 HydrophobicContact CG1-CZ2 3.57Å; V52-W79 HydrophobicContact CG1-CZ3 4.43Å; V52-W79 HydrophobicContact CG2-CD2 4.04Å; V52-W79 HydrophobicContact CG2-CE3 4.08Å; V52-W79 HydrophobicContact CG2-CG 4.32Å
53	E	91	Very high	90.9	Very high	136 Å²	136	72.8 Å²	72.8	64%	0.636	36%	0.364	S	S	*	.	H	α-helix	trans	-66.9	-29.9	172.9	-166.8	157.2	-139	0	0	111.6	K49 K50	K49-E53 IonicContact NZ-OE1 2.7Å; K49-E53 PolarHBondContact NZ-OE1 3.37Å; K49-E53 IonicContact NZ-OE2 3.7Å; K49-E53 PolarHBondContact NZ-OE2 3.43Å; K49-E53 VanDerWaalsContact O-CB 3.25Å; K49-E53 WeakPolarHBondContact O-CB 3.34Å; K49-E53 PolarHBondContact O-N 2.7Å; K50-E53 PolarHBondContact O-N 3.37Å
54	Q	89.9	Confident	90.9	Very high	121 Å²	121	68.2 Å²	68.2	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-90.8	-34.8	177.6	-72.8	177	-37.5	0	0	115.2	K50 L51 V52	K50-Q54 WeakPolarHBondContact O-CB 3.17Å; K50-Q54 VanDerWaalsContact O-CG 3.24Å; K50-Q54 WeakPolarHBondContact O-CG 3.48Å; K50-Q54 PolarHBondContact O-N 2.88Å; L51-Q54 PolarHBondContact O-N 2.78Å; V52-Q54 VanDerWaalsContact C-N 3.29Å; V52-Q54 PolarHBondContact O-N 3.18Å
55	H	86.9	Confident	90.8	Very high	85 Å²	85	72.1 Å²	72.1	39%	0.394	37%	0.368	S	S	.	.	H	α-helix	trans	-115.4	4.3	-174	-62.1	-67.4	0	0	0	114.4	L51 I63	L51-H55 WeakPolarHBondContact O-CB 3.45Å; L51-H55 PolarHBondContact O-CD2 3.3Å; L51-H55 PolarHBondContact O-N 3.36Å; H55-I63 HydrophobicContact CB-CD1 4.38Å; H55-I63 HydrophobicContact CB-CG1 4.3Å
56	G	86.8	Confident	90.5	Very high	35 Å²	35	75.1 Å²	75.1	36%	0.361	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	-170.4	-175.6	0	0	0	0	0	113.7	V52	V52-G56 CarbonylContact O-C 3.5Å; V52-G56 WeakPolarHBondContact O-CA 3.24Å; V52-G56 PolarHBondContact O-N 3.28Å
57	T	84.8	Confident	90.4	Very high	78 Å²	78	70.7 Å²	70.7	48%	0.479	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	18.1	-178.6	51.5	0	0	0	0	113.4	V52 W60	V52-T57 HydrophobicContact CG1-CG2 3.66Å; T57-W60 HydrophobicContact CG2-CH2 4.45Å; T57-W60 HydrophobicContact CG2-CZ2 4.06Å; T57-W60 PolarHBondContact O-NE1 3.08Å
58	E	83.1	Confident	90.1	Very high	175 Å²	175	72 Å²	72	82%	0.818	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-40.6	-176.2	-57.4	-171.4	159	0	0	112.1	W60	E58-W60 PolarHBondContact O-N 3.4Å; E58-W60 VanDerWaalsContact O-N 3.15Å
59	S	89.3	Confident	89.7	Confident	54 Å²	54	73.6 Å²	73.6	38%	0.378	39%	0.394	S	S	.	.			trans	-90.9	46.6	-170.9	-68.4	0	0	0	0	114.7	K61 S62 I63	S59-K61 PolarHBondContact O-N 3.36Å; S59-K61 VanDerWaalsContact O-N 3.1Å; S59-S62 WeakPolarHBondContact O-CB 3.13Å; S59-S62 PolarHBondContact O-N 3.12Å; S59-I63 PolarHBondContact O-N 2.81Å; S59-I63 VanDerWaalsContact O-N 3.1Å
60	W	91.4	Very high	89.5	Confident	20 Å²	20	70.4 Å²	70.4	8%	0.076	38%	0.38	C	S	.	.	H	α-helix	trans	-55.3	-31.6	-175.9	-65	103.4	0	0	0	115	L48 V52 T57 E58 I63 A64 D72 C75 Q76 W79	L48-W60 HydrophobicContact CD1-CZ3 4.41Å; V52-W60 HydrophobicContact CG1-CH2 4.37Å; V52-W60 HydrophobicContact CG2-CH2 3.63Å; V52-W60 HydrophobicContact CG2-CZ3 3.6Å; T57-W60 HydrophobicContact CG2-CH2 4.45Å; T57-W60 HydrophobicContact CG2-CZ2 4.06Å; T57-W60 PolarHBondContact O-NE1 3.08Å; E58-W60 PolarHBondContact O-N 3.4Å; E58-W60 VanDerWaalsContact O-N 3.15Å; W60-I63 HydrophobicContact CE3-CD1 4.15Å; W60-I63 HydrophobicContact CZ3-CD1 4.21Å; W60-I63 PolarHBondContact O-N 2.89Å; W60-A64 WeakPolarHBondContact O-CB 3.38Å; W60-A64 PolarHBondContact O-N 3.33Å; W60-D72 HydrophobicContact CB-CB 3.99Å; W60-C75 HydrophobicContact CE3-CB 4.12Å; W60-C75 HydrophobicContact CZ3-CB 4.46Å; W60-Q76 HydrophobicContact CD2-CB 3.62Å; W60-Q76 HydrophobicContact CD2-CG 4.03Å; W60-Q76 HydrophobicContact CE3-CB 3.9Å; W60-Q76 HydrophobicContact CG-CB 4.02Å; W60-Q76 HydrophobicContact CG-CG 4.39Å; W60-Q76 HydrophobicContact CZ2-CB 4.35Å; W60-Q76 HydrophobicContact CZ2-CG 4.11Å; W60-Q76 HydrophobicContact CZ3-CB 4.39Å; W60-Q76 VanDerWaalsContact NE1-NE2 3.17Å; W60-W79 HydrophobicContact CH2-CB 3.54Å; W60-W79 AromaticContact CH2-CD1 3.64Å; W60-W79 AromaticContact CH2-CG 3.63Å; W60-W79 HydrophobicContact CH2-CG 3.63Å; W60-W79 HydrophobicContact CZ2-CG 4.5Å; W60-W79 HydrophobicContact CZ3-CB 3.99Å; W60-W79 HydrophobicContact CZ3-CG 4.44Å
61	K	91.4	Very high	89.4	Confident	159 Å²	159	67.8 Å²	67.8	69%	0.691	37%	0.374	S	S	*	.	H	α-helix	trans	-64.9	-45.7	176.5	-65.4	179.6	-179.3	178.3	0	111.7	S59 I63 A64 T65 D72	S59-K61 PolarHBondContact O-N 3.36Å; S59-K61 VanDerWaalsContact O-N 3.1Å; K61-I63 VanDerWaalsContact C-N 3.34Å; K61-A64 PolarHBondContact O-N 2.89Å; K61-T65 PolarHBondContact O-N 3.06Å; K61-T65 PolarHBondContact O-OG1 3.23Å; K61-D72 HydrophobicContact CG-CB 4.39Å
62	S	89.7	Confident	89.4	Confident	58 Å²	58	70.3 Å²	70.3	41%	0.406	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-41	175.7	-45.5	0	0	0	0	111.4	S59 T65 F66	S59-S62 WeakPolarHBondContact O-CB 3.13Å; S59-S62 PolarHBondContact O-N 3.12Å; S62-T65 WeakPolarHBondContact O-CB 3.46Å; S62-T65 PolarHBondContact O-N 3.11Å; S62-F66 WeakPolarHBondContact O-CD2 3.47Å; S62-F66 WeakPolarHBondContact O-CE2 3.46Å
63	I	91.2	Very high	89.3	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-62.4	-43.7	176.2	-63.9	175.3	0	0	0	110.5	L48 L51 V52 H55 S59 W60 K61 T65 F66 F67 C75	L48-I63 HydrophobicContact CD1-CG2 3.59Å; L51-I63 HydrophobicContact CB-CG1 4.33Å; L51-I63 HydrophobicContact CB-CG2 4.08Å; L51-I63 HydrophobicContact CD1-CG2 4.42Å; V52-I63 HydrophobicContact CG2-CD1 3.8Å; H55-I63 HydrophobicContact CB-CD1 4.38Å; H55-I63 HydrophobicContact CB-CG1 4.3Å; S59-I63 PolarHBondContact O-N 2.81Å; S59-I63 VanDerWaalsContact O-N 3.1Å; W60-I63 HydrophobicContact CE3-CD1 4.15Å; W60-I63 HydrophobicContact CZ3-CD1 4.21Å; W60-I63 PolarHBondContact O-N 2.89Å; K61-I63 VanDerWaalsContact C-N 3.34Å; I63-T65 VanDerWaalsContact C-N 3.29Å; I63-T65 PolarHBondContact O-N 3.49Å; I63-F66 PolarHBondContact O-N 3.36Å; I63-F66 VanDerWaalsContact O-N 3.16Å; I63-F67 HydrophobicContact CG2-CD2 4.47Å; I63-F67 HydrophobicContact CG2-CE2 3.94Å; I63-F67 WeakPolarHBondContact O-CD2 3.5Å; I63-C75 HydrophobicContact CG2-CB 4.45Å
64	A	92.4	Very high	89.3	Confident	16 Å²	16	66.9 Å²	66.9	13%	0.132	38%	0.381	C	S	.	.	H	α-helix	trans	-61.8	-31.6	179.5	0	0	0	0	0	113.8	W60 K61 F66 F67 D72	W60-A64 WeakPolarHBondContact O-CB 3.38Å; W60-A64 PolarHBondContact O-N 3.33Å; K61-A64 PolarHBondContact O-N 2.89Å; A64-F66 PolarHBondContact O-N 3.45Å; A64-F66 VanDerWaalsContact O-N 3.09Å; A64-F67 PolarHBondContact O-N 3.08Å; A64-D72 HydrophobicContact CB-CB 3.98Å
65	T	92.3	Very high	89.5	Confident	117 Å²	117	61.1 Å²	61.1	72%	0.718	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.7	175.4	-51.3	0	0	0	0	112.7	K61 S62 I63 F67	K61-T65 PolarHBondContact O-N 3.06Å; K61-T65 PolarHBondContact O-OG1 3.23Å; S62-T65 WeakPolarHBondContact O-CB 3.46Å; S62-T65 PolarHBondContact O-N 3.11Å; I63-T65 VanDerWaalsContact C-N 3.29Å; I63-T65 PolarHBondContact O-N 3.49Å; T65-F67 VanDerWaalsContact C-N 3.32Å; T65-F67 PolarHBondContact O-N 2.84Å
66	F	88.2	Confident	89.7	Confident	92 Å²	92	60.5 Å²	60.5	40%	0.404	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-1.7	177.4	-62.1	-82.3	0	0	0	114.4	K47 L51 S62 I63 A64	K47-F66 PolarHBondContact NZ-O 3.19Å; L51-F66 HydrophobicContact CD1-CB 3.5Å; L51-F66 HydrophobicContact CD1-CD2 3.74Å; L51-F66 HydrophobicContact CD1-CG 3.72Å; L51-F66 HydrophobicContact CD2-CD2 3.7Å; L51-F66 HydrophobicContact CD2-CE2 3.78Å; L51-F66 HydrophobicContact CD2-CG 4.09Å; L51-F66 HydrophobicContact CD2-CZ 4.23Å; L51-F66 HydrophobicContact CG-CD2 4.38Å; S62-F66 WeakPolarHBondContact O-CD2 3.47Å; S62-F66 WeakPolarHBondContact O-CE2 3.46Å; I63-F66 PolarHBondContact O-N 3.36Å; I63-F66 VanDerWaalsContact O-N 3.16Å; A64-F66 PolarHBondContact O-N 3.45Å; A64-F66 VanDerWaalsContact O-N 3.09Å
67	F	91.1	Very high	89.9	Confident	7 Å²	7	64.7 Å²	64.7	3%	0.031	36%	0.361	C	S	.	.	S	Bend	trans	-122.4	86.3	-177.1	-65.6	-79.1	0	0	0	111.3	W40 E44 K47 L48 L51 I63 A64 T65 G69 R70	W40-F67 HydrophobicContact CZ3-CD1 4.46Å; W40-F67 HydrophobicContact CZ3-CE1 4.41Å; E44-F67 HydrophobicContact CB-CD1 4.49Å; E44-F67 HydrophobicContact CB-CE1 4.21Å; E44-F67 HydrophobicContact CG-CD1 4.4Å; E44-F67 WeakPolarHBondContact O-CE1 3.05Å; K47-F67 HydrophobicContact CB-CE1 4.11Å; K47-F67 HydrophobicContact CB-CZ 4.03Å; K47-F67 HydrophobicContact CD-CE1 3.95Å; K47-F67 HydrophobicContact CD-CZ 4.08Å; K47-F67 HydrophobicContact CG-CE1 4.2Å; K47-F67 HydrophobicContact CG-CZ 3.94Å; L48-F67 HydrophobicContact CB-CE1 4.34Å; L48-F67 HydrophobicContact CB-CE2 4.29Å; L48-F67 HydrophobicContact CB-CZ 3.68Å; L48-F67 HydrophobicContact CD1-CE2 4.05Å; L48-F67 HydrophobicContact CD1-CZ 4.31Å; L51-F67 HydrophobicContact CD1-CE2 3.62Å; L51-F67 HydrophobicContact CD1-CZ 3.94Å; I63-F67 HydrophobicContact CG2-CD2 4.47Å; I63-F67 HydrophobicContact CG2-CE2 3.94Å; I63-F67 WeakPolarHBondContact O-CD2 3.5Å; A64-F67 PolarHBondContact O-N 3.08Å; T65-F67 VanDerWaalsContact C-N 3.32Å; T65-F67 PolarHBondContact O-N 2.84Å; F67-G69 PolarHBondContact O-N 2.88Å; F67-G69 VanDerWaalsContact O-N 3.12Å; F67-R70 HydrophobicContact CB-CB 3.63Å; F67-R70 HydrophobicContact CB-CG 3.63Å; F67-R70 HydrophobicContact CG-CG 4.36Å; F67-R70 PolarHBondContact O-N 3.48Å
68	P	86.3	Confident	90.2	Very high	126 Å²	126	63.6 Å²	63.6	82%	0.818	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	121.8	176.9	24.6	-33.8	0	0	0	110.1
69	G	85.4	Confident	90.7	Very high	32 Å²	32	56.2 Å²	56.2	33%	0.33	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	3.4	-178	0	0	0	0	0	116.3	L35 F67	L35-G69 WeakPolarHBondContact CB-O 3.07Å; L35-G69 WeakPolarHBondContact CG-O 3.16Å; F67-G69 PolarHBondContact O-N 2.88Å; F67-G69 VanDerWaalsContact O-N 3.12Å
70	R	89.1	Confident	90.7	Very high	21 Å²	21	57.5 Å²	57.5	8%	0.079	31%	0.313	C	S	.	.			trans	-107	153.4	169.9	-51.5	-58.1	-172.1	174.5	4.4	111.7	V38 K39 W40 E44 F67 Q74	V38-R70 PolarHBondContact O-NH1 2.86Å; V38-R70 PolarHBondContact O-NH2 3.05Å; K39-R70 PolarHBondContact O-NH2 3.09Å; W40-R70 HydrophobicContact CH2-CG 4.2Å; W40-R70 HydrophobicContact CZ2-CG 4.34Å; E44-R70 VanDerWaalsContact CD-NH2 3.29Å; E44-R70 IonicContact OE1-CZ 3.19Å; E44-R70 VanDerWaalsContact OE1-CZ 3.3Å; E44-R70 IonicContact OE1-NE 3.77Å; E44-R70 PolarHBondContact OE1-NE 3.39Å; E44-R70 IonicContact OE1-NH2 3.2Å; E44-R70 PolarHBondContact OE1-NH2 3.14Å; E44-R70 IonicContact OE2-CZ 3.62Å; E44-R70 IonicContact OE2-NE 2.91Å; E44-R70 IonicContact OE2-NH2 3.35Å; E44-R70 PolarHBondContact OE2-NH2 2.89Å; F67-R70 HydrophobicContact CB-CB 3.63Å; F67-R70 HydrophobicContact CB-CG 3.63Å; F67-R70 HydrophobicContact CG-CG 4.36Å; F67-R70 PolarHBondContact O-N 3.48Å; R70-Q74 VanDerWaalsContact CA-OE1 3.3Å
71	T	92.8	Very high	90.5	Very high	73 Å²	73	60.6 Å²	60.6	45%	0.448	33%	0.327	S	S	.	.			trans	-100.9	157.5	170.2	63.6	0	0	0	0	111.9	G73 Q74 C75	T71-G73 VanDerWaalsContact C-N 3.27Å; T71-G73 PolarHBondContact O-N 3.01Å; T71-Q74 WeakPolarHBondContact O-CA 3.35Å; T71-Q74 WeakPolarHBondContact O-CB 3.39Å; T71-Q74 PolarHBondContact O-N 2.81Å; T71-Q74 WeakPolarHBondContact OG1-CG 3.28Å; T71-Q74 PolarHBondContact OG1-N 3.31Å; T71-C75 PolarHBondContact O-N 3.46Å; T71-C75 PolarHBondContact O-SG 2.75Å
72	D	91.9	Very high	90.2	Very high	64 Å²	64	55.6 Å²	55.6	34%	0.342	31%	0.31	S	S	.	.	H	α-helix	trans	-52	-43.9	172.4	62.1	-22.8	0	0	0	112.5	W60 K61 A64 Q74 C75 Q76	W60-D72 HydrophobicContact CB-CB 3.99Å; K61-D72 HydrophobicContact CG-CB 4.39Å; A64-D72 HydrophobicContact CB-CB 3.98Å; D72-Q74 VanDerWaalsContact C-N 3.31Å; D72-Q74 PolarHBondContact O-N 2.75Å; D72-C75 PolarHBondContact O-N 3.42Å; D72-Q76 WeakPolarHBondContact O-CB 3.48Å; D72-Q76 PolarHBondContact O-N 3.11Å
73	G	91	Very high	90.1	Very high	36 Å²	36	54.2 Å²	54.2	37%	0.371	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-31.8	173.3	0	0	0	0	0	114	T71 H77	T71-G73 VanDerWaalsContact C-N 3.27Å; T71-G73 PolarHBondContact O-N 3.01Å; G73-H77 WeakPolarHBondContact O-CB 3.36Å; G73-H77 PolarHBondContact O-N 3.01Å
74	Q	91.4	Very high	89.9	Confident	36 Å²	36	55.2 Å²	55.2	17%	0.168	30%	0.303	C	S	.	.	H	α-helix	trans	-74.4	-43.7	174.3	-72.7	169.2	-13.9	0	0	111.8	C36 W40 R70 T71 D72 H77 R78	C36-Q74 PolarHBondContact SG-NE2 3.24Å; W40-Q74 HydrophobicContact CZ2-CB 4.24Å; R70-Q74 VanDerWaalsContact CA-OE1 3.3Å; T71-Q74 WeakPolarHBondContact O-CA 3.35Å; T71-Q74 WeakPolarHBondContact O-CB 3.39Å; T71-Q74 PolarHBondContact O-N 2.81Å; T71-Q74 WeakPolarHBondContact OG1-CG 3.28Å; T71-Q74 PolarHBondContact OG1-N 3.31Å; D72-Q74 VanDerWaalsContact C-N 3.31Å; D72-Q74 PolarHBondContact O-N 2.75Å; Q74-H77 PolarHBondContact O-N 2.94Å; Q74-R78 VanDerWaalsContact O-CB 3.3Å; Q74-R78 WeakPolarHBondContact O-CB 3.32Å; Q74-R78 PolarHBondContact O-N 3.3Å
75	C	92.5	Very high	89.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-58	-47.9	173.4	-64.5	0	0	0	0	110.8	L48 W60 I63 T71 D72 H77 R78 W79	L48-C75 HydrophobicContact CD1-CB 3.93Å; L48-C75 HydrophobicContact CD2-CB 4.48Å; W60-C75 HydrophobicContact CE3-CB 4.12Å; W60-C75 HydrophobicContact CZ3-CB 4.46Å; I63-C75 HydrophobicContact CG2-CB 4.45Å; T71-C75 PolarHBondContact O-N 3.46Å; T71-C75 PolarHBondContact O-SG 2.75Å; D72-C75 PolarHBondContact O-N 3.42Å; C75-H77 PolarHBondContact O-N 3.19Å; C75-R78 PolarHBondContact O-N 2.81Å; C75-W79 PolarHBondContact O-N 3.01Å
76	Q	92.3	Very high	89.1	Confident	71 Å²	71	60.5 Å²	60.5	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-60.1	-46.7	175.9	-176.1	-177	86.2	0	0	112.1	W60 D72 W79 Q80	W60-Q76 HydrophobicContact CD2-CB 3.62Å; W60-Q76 HydrophobicContact CD2-CG 4.03Å; W60-Q76 HydrophobicContact CE3-CB 3.9Å; W60-Q76 HydrophobicContact CG-CB 4.02Å; W60-Q76 HydrophobicContact CG-CG 4.39Å; W60-Q76 HydrophobicContact CZ2-CB 4.35Å; W60-Q76 HydrophobicContact CZ2-CG 4.11Å; W60-Q76 HydrophobicContact CZ3-CB 4.39Å; W60-Q76 VanDerWaalsContact NE1-NE2 3.17Å; D72-Q76 WeakPolarHBondContact O-CB 3.48Å; D72-Q76 PolarHBondContact O-N 3.11Å; Q76-W79 PolarHBondContact O-N 2.89Å; Q76-Q80 HydrophobicContact CG-CG 4.29Å; Q76-Q80 WeakPolarHBondContact O-CB 3.44Å; Q76-Q80 VanDerWaalsContact O-CG 3.31Å; Q76-Q80 WeakPolarHBondContact O-CG 3.32Å; Q76-Q80 PolarHBondContact O-N 3.13Å
77	H	90.8	Very high	89	Confident	123 Å²	123	57.3 Å²	57.3	57%	0.569	31%	0.313	S	S	*	.	H	α-helix	trans	-62.6	-44.5	178.6	-165.5	133.2	0	0	0	111.1	G73 Q74 C75 Q80 K81	G73-H77 WeakPolarHBondContact O-CB 3.36Å; G73-H77 PolarHBondContact O-N 3.01Å; Q74-H77 PolarHBondContact O-N 2.94Å; C75-H77 PolarHBondContact O-N 3.19Å; H77-Q80 PolarHBondContact O-N 2.93Å; H77-K81 VanDerWaalsContact O-CB 3.32Å; H77-K81 WeakPolarHBondContact O-CB 3.44Å; H77-K81 WeakPolarHBondContact O-CG 3.31Å; H77-K81 PolarHBondContact O-N 3.38Å
78	R	91.9	Very high	88.7	Confident	56 Å²	56	59.7 Å²	59.7	21%	0.211	33%	0.328	C	S	.	.	H	α-helix	trans	-60.9	-45.2	178.3	-173.9	66.3	175.4	178.9	-0.4	111.2	W40 D45 L48 Q74 C75 V82 L83	W40-R78 VanDerWaalsContact CB-CZ 3.5Å; W40-R78 HydrophobicContact CD2-CB 4.29Å; W40-R78 HydrophobicContact CD2-CG 3.66Å; W40-R78 HydrophobicContact CE3-CG 3.82Å; W40-R78 HydrophobicContact CG-CG 4.21Å; W40-R78 HydrophobicContact CH2-CB 4.14Å; W40-R78 HydrophobicContact CH2-CG 4.24Å; W40-R78 HydrophobicContact CZ2-CB 3.77Å; W40-R78 HydrophobicContact CZ2-CG 4.06Å; W40-R78 HydrophobicContact CZ3-CG 4.12Å; D45-R78 VanDerWaalsContact CG-NH2 3.31Å; D45-R78 IonicContact OD1-CZ 3.51Å; D45-R78 IonicContact OD1-NE 3.96Å; D45-R78 PolarHBondContact OD1-NE 3.37Å; D45-R78 IonicContact OD1-NH2 3.51Å; D45-R78 PolarHBondContact OD1-NH2 3.32Å; D45-R78 VanDerWaalsContact OD1-NH2 3.13Å; D45-R78 IonicContact OD2-CZ 2.75Å; D45-R78 IonicContact OD2-NE 3.43Å; D45-R78 IonicContact OD2-NH2 2.68Å; D45-R78 PolarHBondContact OD2-NH2 2.72Å; L48-R78 HydrophobicContact CD2-CB 3.8Å; L48-R78 HydrophobicContact CD2-CG 3.78Å; Q74-R78 VanDerWaalsContact O-CB 3.3Å; Q74-R78 WeakPolarHBondContact O-CB 3.32Å; Q74-R78 PolarHBondContact O-N 3.3Å; C75-R78 PolarHBondContact O-N 2.81Å; R78-V82 WeakPolarHBondContact O-CA 3.17Å; R78-V82 WeakPolarHBondContact O-CB 3.17Å; R78-V82 PolarHBondContact O-N 2.89Å; R78-L83 HydrophobicContact CG-CD1 3.92Å; R78-L83 HydrophobicContact CG-CG 4.21Å; R78-L83 PolarHBondContact O-N 2.95Å
79	W	91.8	Very high	88.5	Confident	20 Å²	20	60.8 Å²	60.8	8%	0.076	32%	0.319	C	S	.	.	I	π-helix	trans	-58.4	-62.5	173	-175.6	-107.7	0	0	0	111.7	K49 V52 W60 C75 Q76 K81 V82 L83 N84 P85	K49-W79 HydrophobicContact CB-CZ3 4.18Å; K49-W79 HydrophobicContact CG-CH2 4.37Å; K49-W79 HydrophobicContact CG-CZ3 4.09Å; V52-W79 HydrophobicContact CB-CD2 4.18Å; V52-W79 HydrophobicContact CB-CE3 4.16Å; V52-W79 HydrophobicContact CB-CH2 4.23Å; V52-W79 HydrophobicContact CB-CZ2 4.23Å; V52-W79 HydrophobicContact CB-CZ3 4.23Å; V52-W79 HydrophobicContact CG1-CD2 3.88Å; V52-W79 VanDerWaalsContact CG1-CE2 3.49Å; V52-W79 HydrophobicContact CG1-CE3 4.31Å; V52-W79 HydrophobicContact CG1-CG 4.42Å; V52-W79 HydrophobicContact CG1-CH2 4.06Å; V52-W79 HydrophobicContact CG1-CZ2 3.57Å; V52-W79 HydrophobicContact CG1-CZ3 4.43Å; V52-W79 HydrophobicContact CG2-CD2 4.04Å; V52-W79 HydrophobicContact CG2-CE3 4.08Å; V52-W79 HydrophobicContact CG2-CG 4.32Å; W60-W79 HydrophobicContact CH2-CB 3.54Å; W60-W79 AromaticContact CH2-CD1 3.64Å; W60-W79 AromaticContact CH2-CG 3.63Å; W60-W79 HydrophobicContact CH2-CG 3.63Å; W60-W79 HydrophobicContact CZ2-CG 4.5Å; W60-W79 HydrophobicContact CZ3-CB 3.99Å; W60-W79 HydrophobicContact CZ3-CG 4.44Å; C75-W79 PolarHBondContact O-N 3.01Å; Q76-W79 PolarHBondContact O-N 2.89Å; W79-K81 PolarHBondContact O-N 3.46Å; W79-V82 PolarHBondContact O-N 3.45Å; W79-L83 HydrophobicContact CE3-CB 3.6Å; W79-L83 HydrophobicContact CZ3-CB 3.92Å; W79-L83 PolarHBondContact O-N 2.77Å; W79-N84 HydrophobicContact CD2-CB 4.18Å; W79-N84 HydrophobicContact CG-CB 4.36Å; W79-N84 HydrophobicContact CZ2-CB 4.24Å; W79-N84 WeakPolarHBondContact O-CB 3.18Å; W79-N84 PolarHBondContact O-N 3.05Å; W79-P85 VanDerWaalsContact CH2-CD 3.47Å; W79-P85 VanDerWaalsContact CZ2-CD 3.5Å
80	Q	89.2	Confident	88.6	Confident	81 Å²	81	61 Å²	61	38%	0.379	32%	0.322	S	S	.	.	I	π-helix	trans	-62.7	-16.7	-173.1	-70.9	-177.9	5.4	0	0	115.4	Q76 H77	Q76-Q80 HydrophobicContact CG-CG 4.29Å; Q76-Q80 WeakPolarHBondContact O-CB 3.44Å; Q76-Q80 VanDerWaalsContact O-CG 3.31Å; Q76-Q80 WeakPolarHBondContact O-CG 3.32Å; Q76-Q80 PolarHBondContact O-N 3.13Å; H77-Q80 PolarHBondContact O-N 2.93Å
81	K	87.4	Confident	88.8	Confident	84 Å²	84	65.7 Å²	65.7	37%	0.365	36%	0.355	S	S	.	.	I	π-helix	trans	-120	-13.2	-174.8	-54.5	-64.5	177	-86.4	0	114.2	H77 W79 I123	H77-K81 VanDerWaalsContact O-CB 3.32Å; H77-K81 WeakPolarHBondContact O-CB 3.44Å; H77-K81 WeakPolarHBondContact O-CG 3.31Å; H77-K81 PolarHBondContact O-N 3.38Å; W79-K81 PolarHBondContact O-N 3.46Å; K81-I123 HydrophobicContact CB-CD1 4.44Å; K81-I123 HydrophobicContact CD-CD1 4.36Å; K81-I123 HydrophobicContact CD-CG2 4.47Å; K81-I123 WeakPolarHBondContact O-CD1 3.4Å
82	V	86.1	Confident	88.9	Confident	54 Å²	54	64.5 Å²	64.5	33%	0.327	34%	0.343	S	S	.	.	I	π-helix	trans	-138.4	-41.5	-173.5	-167.2	0	0	0	0	113.5	R78 W79 K89	R78-V82 WeakPolarHBondContact O-CA 3.17Å; R78-V82 WeakPolarHBondContact O-CB 3.17Å; R78-V82 PolarHBondContact O-N 2.89Å; W79-V82 PolarHBondContact O-N 3.45Å; V82-K89 WeakPolarHBondContact O-CE 3.43Å; V82-K89 PolarHBondContact O-NZ 3.24Å
83	L	88.3	Confident	89	Confident	29 Å²	29	64.4 Å²	64.4	15%	0.152	34%	0.344	C	S	.	.	I	π-helix	trans	-105.6	-26.4	-168	-56.7	179.6	0	0	0	115.8	D45 L48 R78 W79	D45-L83 HydrophobicContact CB-CD1 3.9Å; D45-L83 HydrophobicContact CB-CD2 3.79Å; D45-L83 HydrophobicContact CB-CG 4.48Å; L48-L83 HydrophobicContact CB-CD1 4.09Å; L48-L83 HydrophobicContact CD2-CD1 3.75Å; L48-L83 HydrophobicContact CG-CD1 4.02Å; R78-L83 HydrophobicContact CG-CD1 3.92Å; R78-L83 HydrophobicContact CG-CG 4.21Å; R78-L83 PolarHBondContact O-N 2.95Å; W79-L83 HydrophobicContact CE3-CB 3.6Å; W79-L83 HydrophobicContact CZ3-CB 3.92Å; W79-L83 PolarHBondContact O-N 2.77Å
84	N	85.8	Confident	89.2	Confident	22 Å²	22	70.9 Å²	70.9	12%	0.118	36%	0.362	C	S	.	.			trans	-51.8	123.1	-179.6	177.3	4.2	0	0	0	110.8	W79 E86 L87	W79-N84 HydrophobicContact CD2-CB 4.18Å; W79-N84 HydrophobicContact CG-CB 4.36Å; W79-N84 HydrophobicContact CZ2-CB 4.24Å; W79-N84 WeakPolarHBondContact O-CB 3.18Å; W79-N84 PolarHBondContact O-N 3.05Å; N84-E86 PolarHBondContact ND2-OE2 3.03Å; N84-E86 PolarHBondContact O-N 2.95Å; N84-E86 WeakPolarHBondContact OD1-CB 3.31Å; N84-E86 WeakPolarHBondContact OD1-CG 3.42Å; N84-E86 PolarHBondContact OD1-N 2.81Å; N84-E86 PolarHBondContact OD1-OE2 3.04Å; N84-L87 HydrophobicContact CB-CD1 4.05Å; N84-L87 HydrophobicContact CB-CG 4.05Å; N84-L87 VanDerWaalsContact O-CB 3.29Å; N84-L87 WeakPolarHBondContact O-CB 3.42Å; N84-L87 WeakPolarHBondContact O-CG 3.48Å; N84-L87 PolarHBondContact O-N 3.04Å
85	P	84.4	Confident	89.4	Confident	99 Å²	99	74.8 Å²	74.8	64%	0.643	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.3	-178.4	25.8	-35.8	0	0	0	113.6	W79 L87	W79-P85 VanDerWaalsContact CH2-CD 3.47Å; W79-P85 VanDerWaalsContact CZ2-CD 3.5Å; P85-L87 PolarHBondContact O-N 3.32Å
86	E	83.8	Confident	89.5	Confident	144 Å²	144	75.9 Å²	75.9	67%	0.673	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-17	172.2	-59	175	137.1	0	0	113	N84 V88 G121	N84-E86 PolarHBondContact ND2-OE2 3.03Å; N84-E86 PolarHBondContact O-N 2.95Å; N84-E86 WeakPolarHBondContact OD1-CB 3.31Å; N84-E86 WeakPolarHBondContact OD1-CG 3.42Å; N84-E86 PolarHBondContact OD1-N 2.81Å; N84-E86 PolarHBondContact OD1-OE2 3.04Å; E86-V88 PolarHBondContact O-N 2.81Å; E86-G121 WeakPolarHBondContact O-CA 3.44Å
87	L	84.9	Confident	89.7	Confident	25 Å²	25	73.5 Å²	73.5	13%	0.131	38%	0.375	C	S	.	.	S	Bend	trans	-76.6	110	-177.5	-64.1	173.3	0	0	0	111.6	N84 P85 K89 G121 I123	N84-L87 HydrophobicContact CB-CD1 4.05Å; N84-L87 HydrophobicContact CB-CG 4.05Å; N84-L87 VanDerWaalsContact O-CB 3.29Å; N84-L87 WeakPolarHBondContact O-CB 3.42Å; N84-L87 WeakPolarHBondContact O-CG 3.48Å; N84-L87 PolarHBondContact O-N 3.04Å; P85-L87 PolarHBondContact O-N 3.32Å; L87-K89 PolarHBondContact O-N 3.14Å; L87-G121 WeakPolarHBondContact CA-O 3.45Å; L87-I123 HydrophobicContact CD1-CD1 4.4Å; L87-I123 HydrophobicContact CD2-CD1 4Å; L87-I123 HydrophobicContact CD2-CG1 3.87Å
88	V	85.3	Confident	90	Very high	58 Å²	58	72.2 Å²	72.2	35%	0.352	37%	0.37	S	S	.	.			trans	-68.7	97.8	-179.8	-178.6	0	0	0	0	110.5	E86 G121 R122	E86-V88 PolarHBondContact O-N 2.81Å; V88-G121 PolarHBondContact N-O 2.87Å; V88-G121 VanDerWaalsContact N-O 3.09Å; V88-R122 VanDerWaalsContact CG1-CZ 3.45Å; V88-R122 PolarHBondContact O-NH1 3.11Å
89	K	83.6	Confident	90.1	Very high	148 Å²	148	74.6 Å²	74.6	64%	0.643	38%	0.381	S	S	*	.			trans	-93.5	91.6	172.4	-66.7	162.6	-173.9	166.9	0	108.9	V82 L87	V82-K89 WeakPolarHBondContact O-CE 3.43Å; V82-K89 PolarHBondContact O-NZ 3.24Å; L87-K89 PolarHBondContact O-N 3.14Å
90	G	87.2	Confident	90.4	Very high	38 Å²	38	73.7 Å²	73.7	39%	0.392	38%	0.378	S	S	.	.	S	Bend	trans	-177.6	177.8	-177.6	0	0	0	0	0	113	R122	G90-R122 PolarHBondContact O-NH1 2.86Å
91	P	91.6	Very high	90.7	Very high	119 Å²	119	71.9 Å²	71.9	77%	0.773	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-56.5	158	171.7	28.2	-36	0	0	0	110.9	R122	P91-R122 PolarHBondContact O-NH2 3.18Å
92	W	94.9	Very high	91.2	Very high	48 Å²	48	71.8 Å²	71.8	18%	0.182	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-82.3	132.3	174.7	-75.5	80.6	0	0	0	110.2	E96 V100 R122 Q126 R130	W92-E96 WeakPolarHBondContact CA-OE2 3.34Å; W92-E96 HydrophobicContact CE3-CB 3.73Å; W92-E96 HydrophobicContact CZ3-CB 4.06Å; W92-V100 HydrophobicContact CH2-CG2 4.01Å; W92-V100 HydrophobicContact CZ3-CG2 3.57Å; W92-R122 HydrophobicContact CH2-CB 4.28Å; W92-R122 HydrophobicContact CH2-CG 4.14Å; W92-R122 HydrophobicContact CZ3-CG 4.33Å; W92-Q126 HydrophobicContact CZ2-CB 3.89Å; W92-R130 HydrophobicContact CD2-CB 4.2Å; W92-R130 HydrophobicContact CD2-CG 3.64Å; W92-R130 HydrophobicContact CE3-CG 4Å; W92-R130 HydrophobicContact CG-CG 4.01Å; W92-R130 HydrophobicContact CH2-CB 4.18Å; W92-R130 HydrophobicContact CH2-CG 4.41Å; W92-R130 HydrophobicContact CZ2-CB 3.66Å; W92-R130 HydrophobicContact CZ2-CG 4.05Å; W92-R130 HydrophobicContact CZ3-CG 4.39Å
93	T	95.3	Very high	91.7	Very high	61 Å²	61	70.1 Å²	70.1	37%	0.374	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-83.5	163.3	171.6	90.6	0	0	0	0	110.8	E95 E96 D97	T93-E95 WeakPolarHBondContact CB-OE2 3.49Å; T93-E95 PolarHBondContact O-N 3.18Å; T93-E95 PolarHBondContact OG1-N 3.44Å; T93-E95 PolarHBondContact OG1-OE2 3.43Å; T93-E96 HydrophobicContact CG2-CG 4.49Å; T93-E96 PolarHBondContact N-OE2 2.82Å; T93-E96 PolarHBondContact O-N 3.05Å; T93-E96 PolarHBondContact OG1-N 3.31Å; T93-D97 PolarHBondContact O-N 2.72Å
94	K	94.8	Very high	92.1	Very high	173 Å²	173	69 Å²	69	75%	0.752	36%	0.357	S	S	*	.	H	α-helix	trans	-66.7	-30.5	179	-66.7	179.5	-179.6	176.3	0	111.7	D97 Q98	K94-D97 PolarHBondContact O-N 2.9Å; K94-Q98 WeakPolarHBondContact O-CB 3.15Å; K94-Q98 PolarHBondContact O-N 3.39Å
95	E	95	Very high	92.6	Very high	117 Å²	117	75.2 Å²	75.2	55%	0.547	39%	0.386	S	S	.	.	H	α-helix	trans	-74.7	-34.6	-178.9	-52	66.7	-137.2	0	0	110.7	T93 K99	T93-E95 WeakPolarHBondContact CB-OE2 3.49Å; T93-E95 PolarHBondContact O-N 3.18Å; T93-E95 PolarHBondContact OG1-N 3.44Å; T93-E95 PolarHBondContact OG1-OE2 3.43Å; E95-K99 WeakPolarHBondContact O-CB 3.45Å; E95-K99 WeakPolarHBondContact O-CD 3.4Å; E95-K99 WeakPolarHBondContact O-CG 3.44Å; E95-K99 PolarHBondContact O-N 3.24Å; E95-K99 VanDerWaalsContact O-N 3.11Å
96	E	95	Very high	93.2	Very high	24 Å²	24	77.6 Å²	77.6	11%	0.112	39%	0.386	C	S	.	.	H	α-helix	trans	-69.8	-44.2	168.9	-65.1	-179.8	114.5	0	0	112	W92 T93 K99 V100 R122	W92-E96 WeakPolarHBondContact CA-OE2 3.34Å; W92-E96 HydrophobicContact CE3-CB 3.73Å; W92-E96 HydrophobicContact CZ3-CB 4.06Å; T93-E96 HydrophobicContact CG2-CG 4.49Å; T93-E96 PolarHBondContact N-OE2 2.82Å; T93-E96 PolarHBondContact O-N 3.05Å; T93-E96 PolarHBondContact OG1-N 3.31Å; E96-K99 PolarHBondContact O-N 3Å; E96-V100 WeakPolarHBondContact O-CG2 3.49Å; E96-V100 PolarHBondContact O-N 3.07Å; E96-R122 VanDerWaalsContact CD-NH2 3.31Å; E96-R122 WeakPolarHBondContact OE1-CG 3.4Å; E96-R122 IonicContact OE1-CZ 2.72Å; E96-R122 IonicContact OE1-NE 2.72Å; E96-R122 PolarHBondContact OE1-NE 3.32Å; E96-R122 IonicContact OE1-NH2 3.3Å; E96-R122 PolarHBondContact OE1-NH2 2.78Å; E96-R122 VanDerWaalsContact OE1-NH2 3.13Å; E96-R122 IonicContact OE2-CZ 3.52Å; E96-R122 IonicContact OE2-NE 3.65Å; E96-R122 IonicContact OE2-NH2 3.9Å; E96-R122 PolarHBondContact OE2-NH2 3.31Å
97	D	96.1	Very high	93.7	Very high	21 Å²	21	73 Å²	73	11%	0.112	36%	0.363	C	S	.	.	H	α-helix	trans	-60.4	-44.7	176.8	-80.4	-22.1	0	0	0	111.3	T93 K94 V100 I101 R130 L135	T93-D97 PolarHBondContact O-N 2.72Å; K94-D97 PolarHBondContact O-N 2.9Å; D97-V100 PolarHBondContact O-N 2.97Å; D97-I101 WeakPolarHBondContact O-CG1 3.39Å; D97-I101 PolarHBondContact O-N 3.32Å; D97-R130 WeakPolarHBondContact OD1-CG 3.38Å; D97-R130 IonicContact OD1-CZ 3.87Å; D97-R130 IonicContact OD1-NE 3.55Å; D97-R130 PolarHBondContact OD1-NE 3.19Å; D97-R130 IonicContact OD1-NH2 2.61Å; D97-R130 PolarHBondContact OD1-NH2 3.18Å; D97-R130 IonicContact OD2-CZ 3.73Å; D97-R130 IonicContact OD2-NE 2.75Å; D97-R130 IonicContact OD2-NH2 2.71Å; D97-R130 PolarHBondContact OD2-NH2 2.99Å; D97-L135 HydrophobicContact CB-CD1 4.07Å; D97-L135 HydrophobicContact CB-CD2 3.77Å
98	Q	96.9	Very high	94.2	Very high	96 Å²	96	73 Å²	73	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-46.7	175.5	-172.7	60.1	47.6	0	0	111.2	K94 V100 I101 D102	K94-Q98 WeakPolarHBondContact O-CB 3.15Å; K94-Q98 PolarHBondContact O-N 3.39Å; Q98-V100 VanDerWaalsContact C-N 3.3Å; Q98-V100 PolarHBondContact O-N 3.04Å; Q98-I101 WeakPolarHBondContact O-CA 3.22Å; Q98-I101 WeakPolarHBondContact O-CB 3.2Å; Q98-I101 PolarHBondContact O-N 3.33Å; Q98-D102 PolarHBondContact NE2-OD1 3.03Å; Q98-D102 VanDerWaalsContact O-CG 3.26Å; Q98-D102 PolarHBondContact O-N 3.23Å
99	K	95.8	Very high	94.6	Very high	106 Å²	106	73.4 Å²	73.4	46%	0.461	37%	0.372	S	S	.	.	H	α-helix	trans	-56.8	-43	173.4	-75.4	167.5	-173.4	173	0	111.5	E95 E96 I101 D102 L103 L119	E95-K99 WeakPolarHBondContact O-CB 3.45Å; E95-K99 WeakPolarHBondContact O-CD 3.4Å; E95-K99 WeakPolarHBondContact O-CG 3.44Å; E95-K99 PolarHBondContact O-N 3.24Å; E95-K99 VanDerWaalsContact O-N 3.11Å; E96-K99 PolarHBondContact O-N 3Å; K99-I101 VanDerWaalsContact C-N 3.33Å; K99-I101 PolarHBondContact O-N 2.89Å; K99-D102 PolarHBondContact O-N 3.23Å; K99-L103 HydrophobicContact CB-CD1 4.39Å; K99-L103 WeakPolarHBondContact O-CB 3.36Å; K99-L103 WeakPolarHBondContact O-CD1 3.48Å; K99-L103 WeakPolarHBondContact O-CG 3.48Å; K99-L103 PolarHBondContact O-N 3.43Å; K99-L119 HydrophobicContact CB-CD2 3.64Å; K99-L119 HydrophobicContact CD-CD2 4.12Å
100	V	96.8	Very high	95.1	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.3	-42.7	174.5	173.2	0	0	0	0	111.2	W92 E96 D97 Q98 V104 L119 W131 L135	W92-V100 HydrophobicContact CH2-CG2 4.01Å; W92-V100 HydrophobicContact CZ3-CG2 3.57Å; E96-V100 WeakPolarHBondContact O-CG2 3.49Å; E96-V100 PolarHBondContact O-N 3.07Å; D97-V100 PolarHBondContact O-N 2.97Å; Q98-V100 VanDerWaalsContact C-N 3.3Å; Q98-V100 PolarHBondContact O-N 3.04Å; V100-V104 HydrophobicContact CG1-CG2 4.21Å; V100-V104 VanDerWaalsContact O-CB 3.31Å; V100-V104 WeakPolarHBondContact O-CB 3.46Å; V100-V104 WeakPolarHBondContact O-CG2 3.2Å; V100-V104 PolarHBondContact O-N 3.21Å; V100-L119 HydrophobicContact CG2-CD1 3.59Å; V100-W131 HydrophobicContact CG1-CB 4.38Å; V100-W131 HydrophobicContact CG1-CE3 4.35Å; V100-L135 HydrophobicContact CB-CD1 3.77Å; V100-L135 HydrophobicContact CG1-CD1 3.68Å
101	I	96.4	Very high	95.5	Very high	43 Å²	43	79.8 Å²	79.8	22%	0.221	39%	0.385	C	S	.	.	H	α-helix	trans	-61.5	-52.8	177.6	-67.1	160	0	0	0	110.8	D97 Q98 K99 L103 V104 H105 W131 L135	D97-I101 WeakPolarHBondContact O-CG1 3.39Å; D97-I101 PolarHBondContact O-N 3.32Å; Q98-I101 WeakPolarHBondContact O-CA 3.22Å; Q98-I101 WeakPolarHBondContact O-CB 3.2Å; Q98-I101 PolarHBondContact O-N 3.33Å; K99-I101 VanDerWaalsContact C-N 3.33Å; K99-I101 PolarHBondContact O-N 2.89Å; I101-L103 VanDerWaalsContact C-N 3.33Å; I101-L103 PolarHBondContact O-N 2.89Å; I101-V104 PolarHBondContact O-N 3.03Å; I101-V104 VanDerWaalsContact O-N 3.13Å; I101-H105 PolarHBondContact O-N 2.92Å; I101-W131 HydrophobicContact CB-CZ3 4.42Å; I101-W131 HydrophobicContact CG1-CZ3 4.03Å; I101-L135 HydrophobicContact CD1-CB 4.45Å; I101-L135 HydrophobicContact CD1-CD2 4.49Å; I101-L135 HydrophobicContact CG1-CB 4.07Å; I101-L135 HydrophobicContact CG1-CD1 4.34Å
102	D	96.8	Very high	95.7	Very high	82 Å²	82	75.4 Å²	75.4	44%	0.439	35%	0.353	S	S	.	.	H	α-helix	trans	-61.8	-41.2	-178.3	-59	-28	0	0	0	111.7	Q98 K99 H105 K106	Q98-D102 PolarHBondContact NE2-OD1 3.03Å; Q98-D102 VanDerWaalsContact O-CG 3.26Å; Q98-D102 PolarHBondContact O-N 3.23Å; K99-D102 PolarHBondContact O-N 3.23Å; D102-H105 PolarHBondContact O-N 3.49Å; D102-K106 WeakPolarHBondContact O-CB 3.3Å; D102-K106 PolarHBondContact O-N 3.31Å
103	L	96.9	Very high	95.7	Very high	20 Å²	20	77.7 Å²	77.7	11%	0.105	38%	0.376	C	S	.	.	H	α-helix	trans	-70.6	-30.9	177.2	-66.7	166	0	0	0	112.3	K99 I101 Y107 I115 H118 L119	K99-L103 HydrophobicContact CB-CD1 4.39Å; K99-L103 WeakPolarHBondContact O-CB 3.36Å; K99-L103 WeakPolarHBondContact O-CD1 3.48Å; K99-L103 WeakPolarHBondContact O-CG 3.48Å; K99-L103 PolarHBondContact O-N 3.43Å; I101-L103 VanDerWaalsContact C-N 3.33Å; I101-L103 PolarHBondContact O-N 2.89Å; L103-Y107 HydrophobicContact CB-CD2 4.4Å; L103-Y107 HydrophobicContact CD2-CD2 4.07Å; L103-Y107 HydrophobicContact CD2-CE2 3.7Å; L103-Y107 VanDerWaalsContact O-CB 3.31Å; L103-Y107 WeakPolarHBondContact O-CB 3.44Å; L103-Y107 WeakPolarHBondContact O-CD2 3.37Å; L103-Y107 PolarHBondContact O-N 2.79Å; L103-I115 HydrophobicContact CB-CB 4.41Å; L103-I115 HydrophobicContact CB-CG1 4.12Å; L103-I115 HydrophobicContact CB-CG2 3.91Å; L103-I115 HydrophobicContact CD1-CG2 4.1Å; L103-H118 HydrophobicContact CD1-CB 3.54Å; L103-H118 HydrophobicContact CD2-CB 3.65Å; L103-H118 HydrophobicContact CG-CB 4.27Å; L103-L119 HydrophobicContact CD1-CG 4.23Å
104	V	97	Very high	95.7	Very high	5 Å²	5	77.5 Å²	77.5	3%	0.03	38%	0.375	C	S	.	.	H	α-helix	trans	-75.6	-35.2	173	170.8	0	0	0	0	111.5	V100 I101 G108 P109 W112 I115 W131	V100-V104 HydrophobicContact CG1-CG2 4.21Å; V100-V104 VanDerWaalsContact O-CB 3.31Å; V100-V104 WeakPolarHBondContact O-CB 3.46Å; V100-V104 WeakPolarHBondContact O-CG2 3.2Å; V100-V104 PolarHBondContact O-N 3.21Å; I101-V104 PolarHBondContact O-N 3.03Å; I101-V104 VanDerWaalsContact O-N 3.13Å; V104-G108 WeakPolarHBondContact O-CA 3.42Å; V104-G108 PolarHBondContact O-N 2.94Å; V104-P109 HydrophobicContact CG1-CB 3.95Å; V104-W112 HydrophobicContact CG2-CH2 3.7Å; V104-W112 HydrophobicContact CG2-CZ3 3.61Å; V104-I115 HydrophobicContact CG2-CD1 3.73Å; V104-W131 HydrophobicContact CB-CD2 4.27Å; V104-W131 HydrophobicContact CB-CE3 3.94Å; V104-W131 HydrophobicContact CB-CH2 4.25Å; V104-W131 HydrophobicContact CB-CZ3 3.93Å; V104-W131 HydrophobicContact CG1-CD2 3.86Å; V104-W131 HydrophobicContact CG1-CE3 3.93Å; V104-W131 HydrophobicContact CG1-CH2 3.7Å; V104-W131 HydrophobicContact CG1-CZ2 3.61Å; V104-W131 HydrophobicContact CG1-CZ3 3.85Å; V104-W131 HydrophobicContact CG2-CD2 4.04Å; V104-W131 HydrophobicContact CG2-CE3 3.9Å; V104-W131 HydrophobicContact CG2-CG 4.42Å; V104-W131 HydrophobicContact CG2-CZ3 4.41Å
105	H	96.3	Very high	95.7	Very high	153 Å²	153	69.2 Å²	69.2	71%	0.708	34%	0.339	S	S	*	.	H	α-helix	trans	-62.1	-47	167.6	-84.6	-176.5	0	0	0	111.4	I101 D102	I101-H105 PolarHBondContact O-N 2.92Å; D102-H105 PolarHBondContact O-N 3.49Å
106	K	96.1	Very high	95.7	Very high	149 Å²	149	64.3 Å²	64.3	65%	0.648	32%	0.319	S	S	*	.	H	α-helix	trans	-69.6	-39.9	-178.3	-174	173.6	-178.7	175.2	0	114.1	D102	D102-K106 WeakPolarHBondContact O-CB 3.3Å; D102-K106 PolarHBondContact O-N 3.31Å
107	Y	95.3	Very high	95.6	Very high	48 Å²	48	71.8 Å²	71.8	19%	0.188	35%	0.35	C	S	.	.	H	α-helix	trans	-112.1	-9.8	-172.7	-60.5	-62.8	0	0	0	114.9	L103 R111 V114 I115 H118	L103-Y107 HydrophobicContact CB-CD2 4.4Å; L103-Y107 HydrophobicContact CD2-CD2 4.07Å; L103-Y107 HydrophobicContact CD2-CE2 3.7Å; L103-Y107 VanDerWaalsContact O-CB 3.31Å; L103-Y107 WeakPolarHBondContact O-CB 3.44Å; L103-Y107 WeakPolarHBondContact O-CD2 3.37Å; L103-Y107 PolarHBondContact O-N 2.79Å; Y107-R111 VanDerWaalsContact O-CZ 3.26Å; Y107-R111 PolarHBondContact O-NE 2.99Å; Y107-R111 PolarHBondContact O-NH2 3.11Å; Y107-V114 HydrophobicContact CE2-CG1 4.44Å; Y107-I115 HydrophobicContact CD2-CG1 4.46Å; Y107-H118 AromaticContact CE2-CD2 3.7Å; Y107-H118 AromaticContact CE2-NE2 3.52Å; Y107-H118 AromaticContact CZ-NE2 3.65Å; Y107-H118 PolarHBondContact OH-NE2 3.28Å; Y107-H118 VanDerWaalsContact OH-NE2 3.11Å
108	G	94.8	Very high	95.4	Very high	23 Å²	23	75.3 Å²	75.3	24%	0.237	37%	0.366	C	S	.	.			trans	76.7	154.5	-177	0	0	0	0	0	113.7	V104 K110 R111	V104-G108 WeakPolarHBondContact O-CA 3.42Å; V104-G108 PolarHBondContact O-N 2.94Å; G108-K110 PolarHBondContact O-N 3.41Å; G108-R111 PolarHBondContact O-N 3.29Å
109	P	94	Very high	95.1	Very high	67 Å²	67	71.3 Å²	71.3	44%	0.435	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	40.1	-174	31.8	-37.5	0	0	0	114.3	V104 W112	V104-P109 HydrophobicContact CG1-CB 3.95Å; P109-W112 VanDerWaalsContact CA-CZ2 3.41Å; P109-W112 HydrophobicContact CB-CH2 4.03Å; P109-W112 HydrophobicContact CB-CZ2 3.68Å; P109-W112 WeakPolarHBondContact O-CZ2 3.4Å; P109-W112 PolarHBondContact O-NE1 3.17Å; P109-W112 VanDerWaalsContact O-NE1 3.11Å
110	K	94.6	Very high	94.7	Very high	185 Å²	185	74.5 Å²	74.5	80%	0.804	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	-33.7	178.7	-62.7	-177.9	-178.6	177.9	0	112.5	G108 W112	G108-K110 PolarHBondContact O-N 3.41Å; K110-W112 VanDerWaalsContact C-N 3.27Å; K110-W112 VanDerWaalsContact O-CD1 3.3Å; K110-W112 PolarHBondContact O-N 2.99Å
111	R	95.1	Very high	94.3	Very high	136 Å²	136	75.5 Å²	75.5	51%	0.513	37%	0.374	S	S	.	.			trans	-88	48.5	-172.2	-71.3	-174.5	-79.5	-167.8	-5.6	113.4	Y107 G108 S113 V114 I115	Y107-R111 VanDerWaalsContact O-CZ 3.26Å; Y107-R111 PolarHBondContact O-NE 2.99Å; Y107-R111 PolarHBondContact O-NH2 3.11Å; G108-R111 PolarHBondContact O-N 3.29Å; R111-S113 VanDerWaalsContact C-N 3.3Å; R111-S113 PolarHBondContact O-N 3.02Å; R111-V114 HydrophobicContact CB-CB 4.22Å; R111-V114 HydrophobicContact CB-CG2 4.18Å; R111-V114 WeakPolarHBondContact O-CA 3.43Å; R111-V114 WeakPolarHBondContact O-CB 3.46Å; R111-V114 PolarHBondContact O-N 2.97Å; R111-I115 PolarHBondContact O-N 2.97Å
112	W	96.3	Very high	94.1	Very high	27 Å²	27	73.8 Å²	73.8	10%	0.102	37%	0.365	C	S	.	.	H	α-helix	trans	-56.7	-36.2	-172.9	-59.4	109.4	0	0	0	114.8	V104 P109 K110 V114 I115 A116 G124 C127 R128 W131 H132	V104-W112 HydrophobicContact CG2-CH2 3.7Å; V104-W112 HydrophobicContact CG2-CZ3 3.61Å; P109-W112 VanDerWaalsContact CA-CZ2 3.41Å; P109-W112 HydrophobicContact CB-CH2 4.03Å; P109-W112 HydrophobicContact CB-CZ2 3.68Å; P109-W112 WeakPolarHBondContact O-CZ2 3.4Å; P109-W112 PolarHBondContact O-NE1 3.17Å; P109-W112 VanDerWaalsContact O-NE1 3.11Å; K110-W112 VanDerWaalsContact C-N 3.27Å; K110-W112 VanDerWaalsContact O-CD1 3.3Å; K110-W112 PolarHBondContact O-N 2.99Å; W112-V114 VanDerWaalsContact C-N 3.28Å; W112-V114 PolarHBondContact O-N 2.72Å; W112-I115 HydrophobicContact CD2-CD1 4.34Å; W112-I115 HydrophobicContact CE3-CD1 3.7Å; W112-I115 HydrophobicContact CZ3-CD1 3.83Å; W112-A116 WeakPolarHBondContact O-CB 3.47Å; W112-A116 PolarHBondContact O-N 3.27Å; W112-G124 WeakPolarHBondContact O-CA 3.35Å; W112-C127 HydrophobicContact CE3-CB 4.17Å; W112-R128 HydrophobicContact CB-CB 4.49Å; W112-R128 HydrophobicContact CD2-CB 3.58Å; W112-R128 HydrophobicContact CD2-CG 4Å; W112-R128 HydrophobicContact CE3-CB 3.96Å; W112-R128 HydrophobicContact CG-CB 3.8Å; W112-R128 HydrophobicContact CG-CG 4.24Å; W112-R128 HydrophobicContact CZ2-CB 4.46Å; W112-R128 HydrophobicContact CZ2-CG 4.19Å; W112-W131 HydrophobicContact CH2-CB 3.53Å; W112-W131 AromaticContact CH2-CD1 3.63Å; W112-W131 HydrophobicContact CH2-CD2 4.39Å; W112-W131 AromaticContact CH2-CG 3.53Å; W112-W131 HydrophobicContact CH2-CG 3.53Å; W112-W131 HydrophobicContact CZ2-CG 4.44Å; W112-W131 HydrophobicContact CZ3-CB 3.84Å; W112-W131 HydrophobicContact CZ3-CG 4.26Å; W112-H132 AromaticContact CZ2-CE1 3.56Å
113	S	94.6	Very high	94	Very high	95 Å²	95	72 Å²	72	66%	0.664	36%	0.355	S	S	*	.	H	α-helix	trans	-73.2	-15.5	175.6	-50.2	0	0	0	0	114.1	R111	R111-S113 VanDerWaalsContact C-N 3.3Å; R111-S113 PolarHBondContact O-N 3.02Å
114	V	94.8	Very high	93.9	Very high	57 Å²	57	71.5 Å²	71.5	35%	0.345	36%	0.355	S	S	.	.	H	α-helix	trans	-89.3	-45.9	172.7	-176.9	0	0	0	0	109.6	Y107 R111 W112 A116 K117 H118	Y107-V114 HydrophobicContact CE2-CG1 4.44Å; R111-V114 HydrophobicContact CB-CB 4.22Å; R111-V114 HydrophobicContact CB-CG2 4.18Å; R111-V114 WeakPolarHBondContact O-CA 3.43Å; R111-V114 WeakPolarHBondContact O-CB 3.46Å; R111-V114 PolarHBondContact O-N 2.97Å; W112-V114 VanDerWaalsContact C-N 3.28Å; W112-V114 PolarHBondContact O-N 2.72Å; V114-A116 PolarHBondContact O-N 3.01Å; V114-K117 WeakPolarHBondContact O-CB 3.24Å; V114-K117 PolarHBondContact O-N 3.4Å; V114-H118 PolarHBondContact O-CD2 3.34Å
115	I	95.4	Very high	93.7	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-52.5	-45.3	174	-65.8	161.7	0	0	0	110.3	L103 V104 Y107 R111 W112 K117 H118 L119 C127	L103-I115 HydrophobicContact CB-CB 4.41Å; L103-I115 HydrophobicContact CB-CG1 4.12Å; L103-I115 HydrophobicContact CB-CG2 3.91Å; L103-I115 HydrophobicContact CD1-CG2 4.1Å; V104-I115 HydrophobicContact CG2-CD1 3.73Å; Y107-I115 HydrophobicContact CD2-CG1 4.46Å; R111-I115 PolarHBondContact O-N 2.97Å; W112-I115 HydrophobicContact CD2-CD1 4.34Å; W112-I115 HydrophobicContact CE3-CD1 3.7Å; W112-I115 HydrophobicContact CZ3-CD1 3.83Å; I115-K117 VanDerWaalsContact C-N 3.3Å; I115-K117 PolarHBondContact O-N 3.29Å; I115-H118 PolarHBondContact O-N 3.13Å; I115-H118 VanDerWaalsContact O-N 3.13Å; I115-L119 HydrophobicContact CG2-CD1 4.24Å; I115-C127 HydrophobicContact CG2-CB 4.33Å
116	A	94.6	Very high	93.6	Very high	14 Å²	14	74.1 Å²	74.1	12%	0.116	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-58.3	-32.6	175.9	0	0	0	0	0	114.8	W112 V114 H118 L119 R122	W112-A116 WeakPolarHBondContact O-CB 3.47Å; W112-A116 PolarHBondContact O-N 3.27Å; V114-A116 PolarHBondContact O-N 3.01Å; A116-H118 PolarHBondContact O-N 3.29Å; A116-L119 PolarHBondContact O-N 2.98Å; A116-L119 VanDerWaalsContact O-N 3.15Å; A116-R122 WeakPolarHBondContact CB-O 3.27Å
117	K	92.9	Very high	93.6	Very high	180 Å²	180	67 Å²	67	78%	0.783	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-69.8	-16.8	178.8	-70.6	-177.7	176.3	-167.5	0	113.4	V114 I115	V114-K117 WeakPolarHBondContact O-CB 3.24Å; V114-K117 PolarHBondContact O-N 3.4Å; I115-K117 VanDerWaalsContact C-N 3.3Å; I115-K117 PolarHBondContact O-N 3.29Å
118	H	91.4	Very high	93.7	Very high	96 Å²	96	70.6 Å²	70.6	44%	0.444	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-96.3	4.5	175.7	-64.1	-73.2	0	0	0	112.7	L103 Y107 V114 I115 A116	L103-H118 HydrophobicContact CD1-CB 3.54Å; L103-H118 HydrophobicContact CD2-CB 3.65Å; L103-H118 HydrophobicContact CG-CB 4.27Å; Y107-H118 AromaticContact CE2-CD2 3.7Å; Y107-H118 AromaticContact CE2-NE2 3.52Å; Y107-H118 AromaticContact CZ-NE2 3.65Å; Y107-H118 PolarHBondContact OH-NE2 3.28Å; Y107-H118 VanDerWaalsContact OH-NE2 3.11Å; V114-H118 PolarHBondContact O-CD2 3.34Å; I115-H118 PolarHBondContact O-N 3.13Å; I115-H118 VanDerWaalsContact O-N 3.13Å; A116-H118 PolarHBondContact O-N 3.29Å
119	L	91.5	Very high	93.7	Very high	12 Å²	12	74 Å²	74	6%	0.063	36%	0.357	C	S	.	.	S	Bend	trans	-120.4	128.9	177.6	-68.7	161.8	0	0	0	109	K99 V100 L103 I115 A116 G121 R122 C127	K99-L119 HydrophobicContact CB-CD2 3.64Å; K99-L119 HydrophobicContact CD-CD2 4.12Å; V100-L119 HydrophobicContact CG2-CD1 3.59Å; L103-L119 HydrophobicContact CD1-CG 4.23Å; I115-L119 HydrophobicContact CG2-CD1 4.24Å; A116-L119 PolarHBondContact O-N 2.98Å; A116-L119 VanDerWaalsContact O-N 3.15Å; L119-G121 PolarHBondContact O-N 3.34Å; L119-R122 HydrophobicContact CB-CB 4Å; L119-R122 HydrophobicContact CB-CG 4.44Å; L119-R122 HydrophobicContact CD1-CB 4.49Å; L119-C127 VanDerWaalsContact CD1-SG 3.58Å
120	Q	87.9	Confident	93.8	Very high	173 Å²	173	73.4 Å²	73.4	81%	0.808	35%	0.346	S	S	*	.	S	Bend	trans	-70.2	121.7	178.9	-69.7	166.5	-10.2	0	0	109	R122	Q120-R122 PolarHBondContact O-N 3.21Å
121	G	87.6	Confident	93.9	Very high	20 Å²	20	65.5 Å²	65.5	21%	0.206	31%	0.311	C	S	.	.	S	Bend	trans	68.9	-0.6	174.2	0	0	0	0	0	118.3	E86 L87 V88 L119	E86-G121 WeakPolarHBondContact O-CA 3.44Å; L87-G121 WeakPolarHBondContact CA-O 3.45Å; V88-G121 PolarHBondContact N-O 2.87Å; V88-G121 VanDerWaalsContact N-O 3.09Å; L119-G121 PolarHBondContact O-N 3.34Å
122	R	93.5	Very high	93.9	Very high	8 Å²	8	62 Å²	62	3%	0.03	30%	0.3	C	S	.	.			trans	-95.9	129.1	179.7	-61.6	-60.5	-169.6	165.9	14.6	112	V88 G90 P91 W92 E96 A116 L119 Q120	V88-R122 VanDerWaalsContact CG1-CZ 3.45Å; V88-R122 PolarHBondContact O-NH1 3.11Å; G90-R122 PolarHBondContact O-NH1 2.86Å; P91-R122 PolarHBondContact O-NH2 3.18Å; W92-R122 HydrophobicContact CH2-CB 4.28Å; W92-R122 HydrophobicContact CH2-CG 4.14Å; W92-R122 HydrophobicContact CZ3-CG 4.33Å; E96-R122 VanDerWaalsContact CD-NH2 3.31Å; E96-R122 WeakPolarHBondContact OE1-CG 3.4Å; E96-R122 IonicContact OE1-CZ 2.72Å; E96-R122 IonicContact OE1-NE 2.72Å; E96-R122 PolarHBondContact OE1-NE 3.32Å; E96-R122 IonicContact OE1-NH2 3.3Å; E96-R122 PolarHBondContact OE1-NH2 2.78Å; E96-R122 VanDerWaalsContact OE1-NH2 3.13Å; E96-R122 IonicContact OE2-CZ 3.52Å; E96-R122 IonicContact OE2-NE 3.65Å; E96-R122 IonicContact OE2-NH2 3.9Å; E96-R122 PolarHBondContact OE2-NH2 3.31Å; A116-R122 WeakPolarHBondContact CB-O 3.27Å; L119-R122 HydrophobicContact CB-CB 4Å; L119-R122 HydrophobicContact CB-CG 4.44Å; L119-R122 HydrophobicContact CD1-CB 4.49Å; Q120-R122 PolarHBondContact O-N 3.21Å
123	I	93.3	Very high	93.8	Very high	44 Å²	44	61.7 Å²	61.7	23%	0.226	30%	0.301	C	S	.	.			trans	-84	144.2	-179.6	-55.1	176.5	0	0	0	109.9	K81 L87 K125 Q126 C127	K81-I123 HydrophobicContact CB-CD1 4.44Å; K81-I123 HydrophobicContact CD-CD1 4.36Å; K81-I123 HydrophobicContact CD-CG2 4.47Å; K81-I123 WeakPolarHBondContact O-CD1 3.4Å; L87-I123 HydrophobicContact CD1-CD1 4.4Å; L87-I123 HydrophobicContact CD2-CD1 4Å; L87-I123 HydrophobicContact CD2-CG1 3.87Å; I123-K125 HydrophobicContact CG2-CB 4.5Å; I123-K125 PolarHBondContact O-N 2.97Å; I123-Q126 HydrophobicContact CB-CG 4.49Å; I123-Q126 WeakPolarHBondContact O-CA 3.45Å; I123-Q126 WeakPolarHBondContact O-CB 3.4Å; I123-Q126 PolarHBondContact O-N 3.1Å; I123-C127 PolarHBondContact O-N 3.44Å; I123-C127 VanDerWaalsContact O-N 3.08Å; I123-C127 PolarHBondContact O-SG 3.1Å
124	G	94.6	Very high	93.8	Very high	10 Å²	10	61.1 Å²	61.1	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-54.9	-28.4	-179.4	0	0	0	0	0	115	W112 C127 R128	W112-G124 WeakPolarHBondContact O-CA 3.35Å; G124-C127 PolarHBondContact O-N 2.79Å; G124-R128 WeakPolarHBondContact O-CB 3.02Å; G124-R128 PolarHBondContact O-N 3.17Å
125	K	93.5	Very high	93.7	Very high	157 Å²	157	59.4 Å²	59.4	68%	0.683	28%	0.276	S	S	*	.	H	α-helix	trans	-61.2	-49.4	170.4	-175.3	-170.9	171	-169.3	0	111.5	I123 C127 R128 E129	I123-K125 HydrophobicContact CG2-CB 4.5Å; I123-K125 PolarHBondContact O-N 2.97Å; K125-C127 VanDerWaalsContact C-N 3.32Å; K125-C127 PolarHBondContact O-N 3.32Å; K125-R128 PolarHBondContact O-N 2.92Å; K125-E129 VanDerWaalsContact O-CB 3.31Å; K125-E129 WeakPolarHBondContact O-CB 3.34Å; K125-E129 PolarHBondContact O-N 3.32Å
126	Q	94.6	Very high	93.6	Very high	56 Å²	56	60.5 Å²	60.5	26%	0.262	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-41.9	178.4	-58.6	167.3	-72.5	0	0	110.2	W92 I123 R128 E129 R130	W92-Q126 HydrophobicContact CZ2-CB 3.89Å; I123-Q126 HydrophobicContact CB-CG 4.49Å; I123-Q126 WeakPolarHBondContact O-CA 3.45Å; I123-Q126 WeakPolarHBondContact O-CB 3.4Å; I123-Q126 PolarHBondContact O-N 3.1Å; Q126-R128 PolarHBondContact O-N 3.03Å; Q126-E129 PolarHBondContact O-N 3.25Å; Q126-R130 WeakPolarHBondContact O-CB 3.48Å; Q126-R130 PolarHBondContact O-N 3.02Å
127	C	95.9	Very high	93.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.2	-46.2	176.8	-53.8	0	0	0	0	111.7	W112 I115 L119 I123 G124 K125 W131	W112-C127 HydrophobicContact CE3-CB 4.17Å; I115-C127 HydrophobicContact CG2-CB 4.33Å; L119-C127 VanDerWaalsContact CD1-SG 3.58Å; I123-C127 PolarHBondContact O-N 3.44Å; I123-C127 VanDerWaalsContact O-N 3.08Å; I123-C127 PolarHBondContact O-SG 3.1Å; G124-C127 PolarHBondContact O-N 2.79Å; K125-C127 VanDerWaalsContact C-N 3.32Å; K125-C127 PolarHBondContact O-N 3.32Å; C127-W131 WeakPolarHBondContact O-CB 3.2Å; C127-W131 PolarHBondContact O-N 3.06Å
128	R	96.4	Very high	93.4	Very high	123 Å²	123	63.4 Å²	63.4	46%	0.464	31%	0.306	S	S	.	.	H	α-helix	trans	-58.7	-49.1	174.7	-177.2	-176.1	174.3	-80.6	-10	111.1	W112 G124 K125 Q126 W131 H132	W112-R128 HydrophobicContact CB-CB 4.49Å; W112-R128 HydrophobicContact CD2-CB 3.58Å; W112-R128 HydrophobicContact CD2-CG 4Å; W112-R128 HydrophobicContact CE3-CB 3.96Å; W112-R128 HydrophobicContact CG-CB 3.8Å; W112-R128 HydrophobicContact CG-CG 4.24Å; W112-R128 HydrophobicContact CZ2-CB 4.46Å; W112-R128 HydrophobicContact CZ2-CG 4.19Å; G124-R128 WeakPolarHBondContact O-CB 3.02Å; G124-R128 PolarHBondContact O-N 3.17Å; K125-R128 PolarHBondContact O-N 2.92Å; Q126-R128 PolarHBondContact O-N 3.03Å; R128-W131 PolarHBondContact O-N 3.18Å; R128-H132 VanDerWaalsContact CG-CE1 3.46Å; R128-H132 WeakPolarHBondContact CG-CE1 3.2Å; R128-H132 WeakPolarHBondContact CG-ND1 3.43Å; R128-H132 PolarHBondContact NH2-NE2 2.83Å; R128-H132 PolarHBondContact O-N 3.08Å; R128-H132 PolarHBondContact O-ND1 3.09Å
129	E	95.6	Very high	93.5	Very high	93 Å²	93	59.9 Å²	59.9	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-65	-42.2	-176.2	-170.9	167.3	175.2	0	0	111.6	K125 Q126 N133	K125-E129 VanDerWaalsContact O-CB 3.31Å; K125-E129 WeakPolarHBondContact O-CB 3.34Å; K125-E129 PolarHBondContact O-N 3.32Å; Q126-E129 PolarHBondContact O-N 3.25Å; E129-N133 VanDerWaalsContact O-CB 3.27Å; E129-N133 WeakPolarHBondContact O-CB 3.47Å; E129-N133 PolarHBondContact O-N 2.7Å; E129-N133 VanDerWaalsContact O-N 3.11Å; E129-N133 PolarHBondContact O-ND2 2.77Å; E129-N133 VanDerWaalsContact O-ND2 3.17Å
130	R	96.1	Very high	93.5	Very high	56 Å²	56	64 Å²	64	21%	0.211	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-45.9	174.1	-172.7	62.8	173.6	-179.8	-2.6	111.9	W92 D97 Q126 H134 L135	W92-R130 HydrophobicContact CD2-CB 4.2Å; W92-R130 HydrophobicContact CD2-CG 3.64Å; W92-R130 HydrophobicContact CE3-CG 4Å; W92-R130 HydrophobicContact CG-CG 4.01Å; W92-R130 HydrophobicContact CH2-CB 4.18Å; W92-R130 HydrophobicContact CH2-CG 4.41Å; W92-R130 HydrophobicContact CZ2-CB 3.66Å; W92-R130 HydrophobicContact CZ2-CG 4.05Å; W92-R130 HydrophobicContact CZ3-CG 4.39Å; D97-R130 WeakPolarHBondContact OD1-CG 3.38Å; D97-R130 IonicContact OD1-CZ 3.87Å; D97-R130 IonicContact OD1-NE 3.55Å; D97-R130 PolarHBondContact OD1-NE 3.19Å; D97-R130 IonicContact OD1-NH2 2.61Å; D97-R130 PolarHBondContact OD1-NH2 3.18Å; D97-R130 IonicContact OD2-CZ 3.73Å; D97-R130 IonicContact OD2-NE 2.75Å; D97-R130 IonicContact OD2-NH2 2.71Å; D97-R130 PolarHBondContact OD2-NH2 2.99Å; Q126-R130 WeakPolarHBondContact O-CB 3.48Å; Q126-R130 PolarHBondContact O-N 3.02Å; R130-H134 WeakPolarHBondContact O-CB 3.25Å; R130-H134 PolarHBondContact O-N 2.99Å; R130-L135 HydrophobicContact CG-CD1 3.77Å; R130-L135 HydrophobicContact CG-CG 4.05Å; R130-L135 PolarHBondContact O-N 3.25Å
131	W	96.4	Very high	93.7	Very high	18 Å²	18	63.5 Å²	63.5	7%	0.068	30%	0.303	C	S	.	.	I	π-helix	trans	-58.1	-57.7	176.1	176.3	-95.9	0	0	0	112.1	V100 I101 V104 W112 C127 R128 N133 L135 N136	V100-W131 HydrophobicContact CG1-CB 4.38Å; V100-W131 HydrophobicContact CG1-CE3 4.35Å; I101-W131 HydrophobicContact CB-CZ3 4.42Å; I101-W131 HydrophobicContact CG1-CZ3 4.03Å; V104-W131 HydrophobicContact CB-CD2 4.27Å; V104-W131 HydrophobicContact CB-CE3 3.94Å; V104-W131 HydrophobicContact CB-CH2 4.25Å; V104-W131 HydrophobicContact CB-CZ3 3.93Å; V104-W131 HydrophobicContact CG1-CD2 3.86Å; V104-W131 HydrophobicContact CG1-CE3 3.93Å; V104-W131 HydrophobicContact CG1-CH2 3.7Å; V104-W131 HydrophobicContact CG1-CZ2 3.61Å; V104-W131 HydrophobicContact CG1-CZ3 3.85Å; V104-W131 HydrophobicContact CG2-CD2 4.04Å; V104-W131 HydrophobicContact CG2-CE3 3.9Å; V104-W131 HydrophobicContact CG2-CG 4.42Å; V104-W131 HydrophobicContact CG2-CZ3 4.41Å; W112-W131 HydrophobicContact CH2-CB 3.53Å; W112-W131 AromaticContact CH2-CD1 3.63Å; W112-W131 HydrophobicContact CH2-CD2 4.39Å; W112-W131 AromaticContact CH2-CG 3.53Å; W112-W131 HydrophobicContact CH2-CG 3.53Å; W112-W131 HydrophobicContact CZ2-CG 4.44Å; W112-W131 HydrophobicContact CZ3-CB 3.84Å; W112-W131 HydrophobicContact CZ3-CG 4.26Å; C127-W131 WeakPolarHBondContact O-CB 3.2Å; C127-W131 PolarHBondContact O-N 3.06Å; R128-W131 PolarHBondContact O-N 3.18Å; W131-N133 VanDerWaalsContact C-N 3.27Å; W131-N133 PolarHBondContact O-N 2.76Å; W131-L135 HydrophobicContact CE3-CB 3.8Å; W131-L135 HydrophobicContact CZ3-CB 4.24Å; W131-L135 PolarHBondContact O-N 2.81Å; W131-N136 HydrophobicContact CD2-CB 4.29Å; W131-N136 HydrophobicContact CZ2-CB 3.97Å; W131-N136 WeakPolarHBondContact O-CB 3.4Å; W131-N136 PolarHBondContact O-N 3.49Å
132	H	95.1	Very high	93.9	Very high	62 Å²	62	65.9 Å²	65.9	29%	0.287	32%	0.317	S	S	.	.	I	π-helix	trans	-65.8	-28.5	-173.4	-71.1	71.3	0	0	0	112.9	W112 R128 V139 T174	W112-H132 AromaticContact CZ2-CE1 3.56Å; R128-H132 VanDerWaalsContact CG-CE1 3.46Å; R128-H132 WeakPolarHBondContact CG-CE1 3.2Å; R128-H132 WeakPolarHBondContact CG-ND1 3.43Å; R128-H132 PolarHBondContact NH2-NE2 2.83Å; R128-H132 PolarHBondContact O-N 3.08Å; R128-H132 PolarHBondContact O-ND1 3.09Å; H132-V139 WeakPolarHBondContact O-CG2 3.45Å; H132-T174 VanDerWaalsContact O-CG2 3.32Å; H132-T174 WeakPolarHBondContact O-CG2 3.49Å
133	N	95.2	Very high	93.9	Very high	21 Å²	21	70.4 Å²	70.4	11%	0.112	35%	0.349	C	S	.	.	I	π-helix	trans	-95.9	-22.3	-177.5	-72.1	-42.3	0	0	0	115.3	E129 W131 T174 N176	E129-N133 VanDerWaalsContact O-CB 3.27Å; E129-N133 WeakPolarHBondContact O-CB 3.47Å; E129-N133 PolarHBondContact O-N 2.7Å; E129-N133 VanDerWaalsContact O-N 3.11Å; E129-N133 PolarHBondContact O-ND2 2.77Å; E129-N133 VanDerWaalsContact O-ND2 3.17Å; W131-N133 VanDerWaalsContact C-N 3.27Å; W131-N133 PolarHBondContact O-N 2.76Å; N133-T174 PolarHBondContact OD1-OG1 3.35Å; N133-N176 VanDerWaalsContact OD1-CB 3.24Å; N133-N176 WeakPolarHBondContact OD1-CB 3.37Å
134	H	93.2	Very high	94	Very high	84 Å²	84	71.6 Å²	71.6	39%	0.389	35%	0.351	S	S	.	.	I	π-helix	trans	-141.8	-30.3	-167.5	-57.6	-71.6	0	0	0	116.1	R130 K141	R130-H134 WeakPolarHBondContact O-CB 3.25Å; R130-H134 PolarHBondContact O-N 2.99Å; H134-K141 WeakPolarHBondContact O-CE 3.35Å; H134-K141 PolarHBondContact O-NZ 2.96Å
135	L	93.6	Very high	94	Very high	21 Å²	21	74.1 Å²	74.1	11%	0.11	36%	0.364	C	S	.	.	I	π-helix	trans	-106.5	-26.1	-170.6	-50.4	178.9	0	0	0	114.4	D97 V100 I101 R130 W131 P137	D97-L135 HydrophobicContact CB-CD1 4.07Å; D97-L135 HydrophobicContact CB-CD2 3.77Å; V100-L135 HydrophobicContact CB-CD1 3.77Å; V100-L135 HydrophobicContact CG1-CD1 3.68Å; I101-L135 HydrophobicContact CD1-CB 4.45Å; I101-L135 HydrophobicContact CD1-CD2 4.49Å; I101-L135 HydrophobicContact CG1-CB 4.07Å; I101-L135 HydrophobicContact CG1-CD1 4.34Å; R130-L135 HydrophobicContact CG-CD1 3.77Å; R130-L135 HydrophobicContact CG-CG 4.05Å; R130-L135 PolarHBondContact O-N 3.25Å; W131-L135 HydrophobicContact CE3-CB 3.8Å; W131-L135 HydrophobicContact CZ3-CB 4.24Å; W131-L135 PolarHBondContact O-N 2.81Å; L135-P137 WeakPolarHBondContact O-CD 3.32Å
136	N	93	Very high	94	Very high	23 Å²	23	70.7 Å²	70.7	12%	0.123	35%	0.351	C	S	.	.	S	Bend	trans	-58.2	122.5	172.7	-179.3	5.3	0	0	0	109.8	W131 E138 V139	W131-N136 HydrophobicContact CD2-CB 4.29Å; W131-N136 HydrophobicContact CZ2-CB 3.97Å; W131-N136 WeakPolarHBondContact O-CB 3.4Å; W131-N136 PolarHBondContact O-N 3.49Å; N136-E138 PolarHBondContact ND2-OE2 3.21Å; N136-E138 PolarHBondContact O-N 2.9Å; N136-E138 VanDerWaalsContact O-N 3.11Å; N136-E138 WeakPolarHBondContact OD1-CG 3.35Å; N136-E138 PolarHBondContact OD1-N 3.39Å; N136-E138 PolarHBondContact OD1-OE2 2.85Å; N136-V139 HydrophobicContact CB-CG2 4.05Å; N136-V139 WeakPolarHBondContact O-CB 3.26Å; N136-V139 PolarHBondContact O-N 3.15Å
137	P	92.2	Very high	94	Very high	112 Å²	112	72.7 Å²	72.7	73%	0.727	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.2	-179.4	24	-35.3	0	0	0	114	L135 V139	L135-P137 WeakPolarHBondContact O-CD 3.32Å; P137-V139 PolarHBondContact O-N 3.31Å
138	E	91.3	Very high	94	Very high	143 Å²	143	73.6 Å²	73.6	67%	0.668	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.2	173.3	-59.1	174	141.1	0	0	113.3	N136 K140 G172	N136-E138 PolarHBondContact ND2-OE2 3.21Å; N136-E138 PolarHBondContact O-N 2.9Å; N136-E138 VanDerWaalsContact O-N 3.11Å; N136-E138 WeakPolarHBondContact OD1-CG 3.35Å; N136-E138 PolarHBondContact OD1-N 3.39Å; N136-E138 PolarHBondContact OD1-OE2 2.85Å; E138-K140 PolarHBondContact O-N 2.99Å; E138-G172 WeakPolarHBondContact O-CA 3.24Å
139	V	93.4	Very high	93.9	Very high	21 Å²	21	68.1 Å²	68.1	13%	0.127	35%	0.345	C	S	.	.	S	Bend	trans	-81.5	110.7	-175.6	-180	0	0	0	0	111.4	H132 N136 P137 K141 T174	H132-V139 WeakPolarHBondContact O-CG2 3.45Å; N136-V139 HydrophobicContact CB-CG2 4.05Å; N136-V139 WeakPolarHBondContact O-CB 3.26Å; N136-V139 PolarHBondContact O-N 3.15Å; P137-V139 PolarHBondContact O-N 3.31Å; V139-K141 PolarHBondContact O-N 3Å; V139-T174 HydrophobicContact CG1-CG2 4.08Å; V139-T174 HydrophobicContact CG2-CG2 3.87Å
140	K	90.7	Very high	93.9	Very high	99 Å²	99	68.2 Å²	68.2	43%	0.43	34%	0.341	S	S	.	.			trans	-68.2	115.7	177.3	-72.6	175	176.3	167.7	0	111.7	E138 P171 G172 R173	E138-K140 PolarHBondContact O-N 2.99Å; K140-P171 WeakPolarHBondContact CD-O 3.49Å; K140-P171 WeakPolarHBondContact CE-O 3.46Å; K140-P171 PolarHBondContact NZ-O 3.12Å; K140-G172 PolarHBondContact N-O 3.15Å; K140-R173 PolarHBondContact O-NH1 2.88Å
141	K	91.9	Very high	93.9	Very high	163 Å²	163	68.8 Å²	68.8	71%	0.709	35%	0.347	S	S	*	.			trans	-93.7	7.2	176.5	-64.9	166	-174	174.6	0	113.3	H134 V139	H134-K141 WeakPolarHBondContact O-CE 3.35Å; H134-K141 PolarHBondContact O-NZ 2.96Å; V139-K141 PolarHBondContact O-N 3Å
142	S	92.3	Very high	93.9	Very high	69 Å²	69	67.9 Å²	67.9	48%	0.483	34%	0.344	S	S	.	.	S	Bend	trans	-67.8	160.6	175.3	55.3	0	0	0	0	112.5	R173	S142-R173 PolarHBondContact O-NH1 3.35Å; S142-R173 PolarHBondContact O-NH2 3.45Å; S142-R173 PolarHBondContact OG-NH2 2.93Å
143	S	93.9	Very high	93.9	Very high	103 Å²	103	67.6 Å²	67.6	72%	0.72	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-53.2	155.9	163.3	44.4	0	0	0	0	111.6	R173	S143-R173 PolarHBondContact O-NH2 3.12Å
144	W	95.2	Very high	93.9	Very high	70 Å²	70	69.3 Å²	69.3	27%	0.265	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-74.9	137	174.4	-66.4	99.3	0	0	0	110.7	E148 I152 R173 S177 I178 H181	W144-E148 WeakPolarHBondContact CA-OE2 3.48Å; W144-E148 HydrophobicContact CE3-CB 4.06Å; W144-I152 HydrophobicContact CE3-CD1 4.07Å; W144-I152 HydrophobicContact CH2-CD1 4.28Å; W144-I152 HydrophobicContact CZ3-CD1 3.68Å; W144-R173 HydrophobicContact CH2-CB 4.09Å; W144-R173 HydrophobicContact CH2-CG 3.94Å; W144-R173 HydrophobicContact CZ3-CB 4.22Å; W144-R173 HydrophobicContact CZ3-CG 3.67Å; W144-S177 WeakPolarHBondContact CZ2-O 3.22Å; W144-I178 HydrophobicContact CH2-CG1 3.84Å; W144-I178 HydrophobicContact CZ3-CG1 4.35Å; W144-H181 AromaticContact CD1-CD2 4Å; W144-H181 AromaticContact CD1-CE1 3.57Å; W144-H181 AromaticContact CD1-CG 3.71Å; W144-H181 AromaticContact CD1-ND1 3.46Å; W144-H181 AromaticContact CD1-NE2 3.91Å; W144-H181 HydrophobicContact CD2-CB 4.33Å; W144-H181 AromaticContact CD2-CD2 3.55Å; W144-H181 AromaticContact CD2-CG 3.84Å; W144-H181 AromaticContact CD2-NE2 3.84Å; W144-H181 AromaticContact CE2-CD2 3.74Å; W144-H181 AromaticContact CE2-CG 3.57Å; W144-H181 AromaticContact CE3-CD2 3.94Å; W144-H181 AromaticContact CG-CD2 3.75Å; W144-H181 AromaticContact CG-CE1 3.64Å; W144-H181 AromaticContact CG-CG 3.93Å; W144-H181 AromaticContact CG-ND1 3.9Å; W144-H181 AromaticContact CG-NE2 3.55Å; W144-H181 HydrophobicContact CH2-CB 4.41Å; W144-H181 HydrophobicContact CZ2-CB 3.65Å; W144-H181 AromaticContact NE1-CD2 4Å; W144-H181 AromaticContact NE1-CG 3.49Å; W144-H181 AromaticContact NE1-ND1 3.63Å
145	T	94.9	Very high	94.1	Very high	62 Å²	62	65.6 Å²	65.6	38%	0.38	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-94.4	158.9	174.3	72.3	0	0	0	0	111.6	E147 E148 D149	T145-E147 PolarHBondContact O-N 3.45Å; T145-E148 PolarHBondContact N-OE2 3.35Å; T145-E148 PolarHBondContact O-N 2.86Å; T145-E148 WeakPolarHBondContact OG1-CG 3.45Å; T145-E148 PolarHBondContact OG1-N 3.05Å; T145-D149 PolarHBondContact O-N 2.93Å
146	Q	92.6	Very high	94.2	Very high	86 Å²	86	66.2 Å²	66.2	40%	0.402	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-28	177.4	-157.7	-172.2	34	0	0	111.6	D149 R150 L196	Q146-D149 PolarHBondContact O-N 3.46Å; Q146-R150 WeakPolarHBondContact O-CG 3.47Å; Q146-R150 PolarHBondContact O-N 3.09Å; Q146-L196 HydrophobicContact CG-CD2 3.57Å
147	E	94.7	Very high	94.3	Very high	98 Å²	98	71.2 Å²	71.2	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-66	-44	173.6	-69.9	57.4	-132.2	0	0	111.6	T145 D149 R150 I151	T145-E147 PolarHBondContact O-N 3.45Å; E147-D149 VanDerWaalsContact C-N 3.35Å; E147-R150 PolarHBondContact O-N 3.08Å; E147-R150 IonicContact OE1-CZ 2.69Å; E147-R150 IonicContact OE1-NH1 3.24Å; E147-R150 PolarHBondContact OE1-NH1 3.11Å; E147-R150 IonicContact OE1-NH2 2.7Å; E147-R150 PolarHBondContact OE1-NH2 2.87Å; E147-I151 VanDerWaalsContact O-CG1 3.32Å; E147-I151 WeakPolarHBondContact O-CG1 3.31Å; E147-I151 PolarHBondContact O-N 3.47Å
148	E	96.2	Very high	94.5	Very high	19 Å²	19	74.5 Å²	74.5	9%	0.089	35%	0.353	C	S	.	.	H	α-helix	trans	-62.6	-43.8	172.8	-69.7	177.2	130.6	0	0	110.6	W144 T145 R150 I151 I152 L170 R173	W144-E148 WeakPolarHBondContact CA-OE2 3.48Å; W144-E148 HydrophobicContact CE3-CB 4.06Å; T145-E148 PolarHBondContact N-OE2 3.35Å; T145-E148 PolarHBondContact O-N 2.86Å; T145-E148 WeakPolarHBondContact OG1-CG 3.45Å; T145-E148 PolarHBondContact OG1-N 3.05Å; E148-R150 PolarHBondContact O-N 3.3Å; E148-I151 PolarHBondContact O-N 2.83Å; E148-I152 VanDerWaalsContact O-CG1 3.28Å; E148-I152 WeakPolarHBondContact O-CG1 3.36Å; E148-I152 PolarHBondContact O-N 3.29Å; E148-L170 HydrophobicContact CB-CD2 3.91Å; E148-L170 HydrophobicContact CG-CD2 3.88Å; E148-R173 WeakPolarHBondContact OE1-CG 3.47Å; E148-R173 IonicContact OE1-CZ 2.66Å; E148-R173 IonicContact OE1-NE 3.13Å; E148-R173 PolarHBondContact OE1-NE 3.49Å; E148-R173 IonicContact OE1-NH2 3.33Å; E148-R173 PolarHBondContact OE1-NH2 3.22Å; E148-R173 IonicContact OE2-CZ 2.96Å; E148-R173 IonicContact OE2-NE 3.16Å; E148-R173 IonicContact OE2-NH2 2.72Å; E148-R173 PolarHBondContact OE2-NH2 3.21Å
149	D	95.1	Very high	94.7	Very high	8 Å²	8	69.9 Å²	69.9	4%	0.043	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-45.4	174.7	-81.9	25.7	0	0	0	111.9	T145 Q146 E147 I151 I152 Y153 H181 M186 L196	T145-D149 PolarHBondContact O-N 2.93Å; Q146-D149 PolarHBondContact O-N 3.46Å; E147-D149 VanDerWaalsContact C-N 3.35Å; D149-I151 VanDerWaalsContact C-N 3.31Å; D149-I151 PolarHBondContact O-N 3.28Å; D149-I152 PolarHBondContact O-N 3.15Å; D149-Y153 WeakPolarHBondContact O-CB 3.49Å; D149-Y153 PolarHBondContact O-N 2.75Å; D149-H181 IonicContact OD1-CD2 3.47Å; D149-H181 IonicContact OD1-CE1 3.31Å; D149-H181 IonicContact OD1-NE2 2.7Å; D149-H181 PolarHBondContact OD1-NE2 3.06Å; D149-H181 IonicContact OD2-NE2 2.74Å; D149-M186 HydrophobicContact CB-CE 3.67Å; D149-M186 HydrophobicContact CB-SD 4.33Å; D149-M186 WeakPolarHBondContact O-CE 3.44Å; D149-L196 HydrophobicContact CB-CD1 3.94Å; D149-L196 HydrophobicContact CB-CD2 4.28Å; D149-L196 WeakPolarHBondContact O-CD1 3.39Å
150	R	94.8	Very high	94.8	Very high	94 Å²	94	70.2 Å²	70.2	36%	0.355	34%	0.34	S	S	.	.	H	α-helix	trans	-58.5	-42.2	174.8	-72.8	-177.9	-136	117.7	10.3	111.6	Q146 E147 E148 E154 L196	Q146-R150 WeakPolarHBondContact O-CG 3.47Å; Q146-R150 PolarHBondContact O-N 3.09Å; E147-R150 PolarHBondContact O-N 3.08Å; E147-R150 IonicContact OE1-CZ 2.69Å; E147-R150 IonicContact OE1-NH1 3.24Å; E147-R150 PolarHBondContact OE1-NH1 3.11Å; E147-R150 IonicContact OE1-NH2 2.7Å; E147-R150 PolarHBondContact OE1-NH2 2.87Å; E148-R150 PolarHBondContact O-N 3.3Å; R150-E154 PolarHBondContact O-N 2.68Å; R150-E154 VanDerWaalsContact O-N 3.08Å; R150-L196 HydrophobicContact CG-CB 4.33Å; R150-L196 HydrophobicContact CG-CD1 4.4Å; R150-L196 HydrophobicContact CG-CD2 3.95Å; R150-L196 HydrophobicContact CG-CG 4.45Å
151	I	96.1	Very high	95.1	Very high	68 Å²	68	70.9 Å²	70.9	35%	0.349	35%	0.348	S	S	.	.	H	α-helix	trans	-65.6	-45.4	176.3	-67	163	0	0	0	110.9	E147 E148 D149 A155 L169 L170	E147-I151 VanDerWaalsContact O-CG1 3.32Å; E147-I151 WeakPolarHBondContact O-CG1 3.31Å; E147-I151 PolarHBondContact O-N 3.47Å; E148-I151 PolarHBondContact O-N 2.83Å; D149-I151 VanDerWaalsContact C-N 3.31Å; D149-I151 PolarHBondContact O-N 3.28Å; I151-A155 WeakPolarHBondContact O-CB 3.25Å; I151-A155 PolarHBondContact O-N 3.43Å; I151-L169 HydrophobicContact CG2-CB 3.8Å; I151-L169 HydrophobicContact CG2-CD1 4.47Å; I151-L170 HydrophobicContact CB-CD2 3.94Å; I151-L170 HydrophobicContact CD1-CD2 4.13Å; I151-L170 HydrophobicContact CG2-CD1 4.23Å; I151-L170 HydrophobicContact CG2-CD2 3.74Å; I151-L170 HydrophobicContact CG2-CG 3.81Å
152	I	96.4	Very high	95.3	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-46.8	178.5	-66	167.6	0	0	0	110.6	W144 E148 D149 H156 L170 I178 W182 M186	W144-I152 HydrophobicContact CE3-CD1 4.07Å; W144-I152 HydrophobicContact CH2-CD1 4.28Å; W144-I152 HydrophobicContact CZ3-CD1 3.68Å; E148-I152 VanDerWaalsContact O-CG1 3.28Å; E148-I152 WeakPolarHBondContact O-CG1 3.36Å; E148-I152 PolarHBondContact O-N 3.29Å; D149-I152 PolarHBondContact O-N 3.15Å; I152-H156 WeakPolarHBondContact O-CB 3.32Å; I152-H156 PolarHBondContact O-N 3.45Å; I152-L170 HydrophobicContact CD1-CD1 4.16Å; I152-L170 HydrophobicContact CG1-CD1 3.44Å; I152-L170 VanDerWaalsContact CG1-CD1 3.44Å; I152-I178 HydrophobicContact CD1-CG2 4.1Å; I152-I178 HydrophobicContact CG1-CG2 3.96Å; I152-I178 HydrophobicContact CG2-CG2 4.06Å; I152-W182 HydrophobicContact CG2-CE3 3.87Å; I152-W182 HydrophobicContact CG2-CZ3 4.47Å; I152-M186 HydrophobicContact CB-SD 3.78Å; I152-M186 HydrophobicContact CD1-SD 4.24Å; I152-M186 HydrophobicContact CG2-SD 3.56Å; I152-M186 VanDerWaalsContact CG2-SD 3.56Å
153	Y	94.8	Very high	95.6	Very high	56 Å²	56	68.5 Å²	68.5	22%	0.22	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-52.5	-179.5	171.2	-106.7	0	0	0	112.2	D149 A155 H156 K157 W182 V190 L196	D149-Y153 WeakPolarHBondContact O-CB 3.49Å; D149-Y153 PolarHBondContact O-N 2.75Å; Y153-A155 VanDerWaalsContact C-N 3.35Å; Y153-A155 PolarHBondContact O-N 3Å; Y153-H156 PolarHBondContact O-N 3.27Å; Y153-K157 HydrophobicContact CE1-CD 4.05Å; Y153-K157 WeakPolarHBondContact O-CB 3.3Å; Y153-K157 PolarHBondContact O-N 3.38Å; Y153-W182 HydrophobicContact CD2-CH2 4.39Å; Y153-W182 HydrophobicContact CD2-CZ3 4.45Å; Y153-V190 HydrophobicContact CD2-CB 4.48Å; Y153-V190 HydrophobicContact CD2-CG1 3.73Å; Y153-V190 HydrophobicContact CD2-CG2 3.83Å; Y153-V190 HydrophobicContact CE2-CG1 3.44Å; Y153-V190 VanDerWaalsContact CE2-CG1 3.44Å; Y153-V190 HydrophobicContact CE2-CG2 4.34Å; Y153-L196 HydrophobicContact CG-CD1 4.45Å
154	E	95.4	Very high	95.7	Very high	57 Å²	57	66.5 Å²	66.5	27%	0.266	31%	0.314	S	S	.	.	H	α-helix	trans	-67.4	-34.6	179.9	-85.4	-66.6	133.4	0	0	112.5	R150 K157 R158	R150-E154 PolarHBondContact O-N 2.68Å; R150-E154 VanDerWaalsContact O-N 3.08Å; E154-K157 WeakPolarHBondContact OE1-CD 3.44Å; E154-K157 WeakPolarHBondContact OE1-CE 3.39Å; E154-K157 IonicContact OE1-NZ 2.69Å; E154-K157 PolarHBondContact OE1-NZ 2.58Å; E154-R158 WeakPolarHBondContact O-CB 3.05Å; E154-R158 VanDerWaalsContact O-CD 3.24Å; E154-R158 WeakPolarHBondContact O-CD 3.34Å; E154-R158 WeakPolarHBondContact O-CG 3.38Å; E154-R158 PolarHBondContact O-N 3.36Å; E154-R158 PolarHBondContact O-NE 3.18Å; E154-R158 IonicContact OE2-CZ 2.82Å; E154-R158 VanDerWaalsContact OE2-CZ 3.24Å; E154-R158 IonicContact OE2-NE 2.71Å; E154-R158 PolarHBondContact OE2-NE 3.15Å; E154-R158 IonicContact OE2-NH2 3.12Å; E154-R158 PolarHBondContact OE2-NH2 3.15Å
155	A	96.9	Very high	95.8	Very high	5 Å²	5	67.1 Å²	67.1	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-70.7	-39.9	175	0	0	0	0	0	112.1	I151 Y153 R158 L159 I166 L169	I151-A155 WeakPolarHBondContact O-CB 3.25Å; I151-A155 PolarHBondContact O-N 3.43Å; Y153-A155 VanDerWaalsContact C-N 3.35Å; Y153-A155 PolarHBondContact O-N 3Å; A155-R158 PolarHBondContact O-N 3.39Å; A155-L159 WeakPolarHBondContact O-CA 3.31Å; A155-L159 WeakPolarHBondContact O-CB 3.47Å; A155-L159 WeakPolarHBondContact O-CG 3.42Å; A155-L159 PolarHBondContact O-N 3.28Å; A155-I166 HydrophobicContact CB-CB 4.41Å; A155-I166 HydrophobicContact CB-CD1 4.49Å; A155-I166 HydrophobicContact CB-CG1 3.93Å; A155-I166 HydrophobicContact CB-CG2 3.93Å; A155-L169 HydrophobicContact CB-CD1 3.67Å
156	H	96	Very high	95.9	Very high	34 Å²	34	64.1 Å²	64.1	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-66.2	-42.2	175.3	-173.6	-89	0	0	0	111.7	I152 Y153 R158 L159 G160 N161 W163 I166 W182	I152-H156 WeakPolarHBondContact O-CB 3.32Å; I152-H156 PolarHBondContact O-N 3.45Å; Y153-H156 PolarHBondContact O-N 3.27Å; H156-R158 PolarHBondContact O-N 3.06Å; H156-L159 PolarHBondContact O-N 3.37Å; H156-G160 PolarHBondContact CD2-O 3.26Å; H156-G160 VanDerWaalsContact CD2-O 3.31Å; H156-G160 WeakPolarHBondContact O-CA 3.28Å; H156-G160 PolarHBondContact O-N 3.09Å; H156-N161 PolarHBondContact NE2-OD1 3.44Å; H156-W163 AromaticContact CD2-CH2 3.36Å; H156-W163 WeakPolarHBondContact CD2-CH2 3.44Å; H156-W163 AromaticContact CD2-CZ3 3.71Å; H156-W163 AromaticContact NE2-CH2 3.68Å; H156-I166 HydrophobicContact CB-CD1 4.26Å; H156-W182 HydrophobicContact CB-CH2 4.28Å; H156-W182 HydrophobicContact CB-CZ3 4.19Å; H156-W182 AromaticContact CE1-CE2 3.81Å; H156-W182 AromaticContact CE1-CZ2 3.55Å; H156-W182 AromaticContact CG-CH2 3.99Å; H156-W182 AromaticContact CG-CZ2 3.93Å; H156-W182 AromaticContact ND1-CE2 3.92Å; H156-W182 AromaticContact ND1-CH2 3.62Å; H156-W182 AromaticContact ND1-CZ2 3.39Å; H156-W182 WeakPolarHBondContact ND1-CZ2 3.46Å; H156-W182 AromaticContact NE2-CE2 3.97Å; H156-W182 AromaticContact NE2-NE1 3.95Å
157	K	94.7	Very high	96.1	Very high	129 Å²	129	61.4 Å²	61.4	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-58.4	-31.8	173.3	178.3	176	168	-171.7	0	113.5	Y153 E154	Y153-K157 HydrophobicContact CE1-CD 4.05Å; Y153-K157 WeakPolarHBondContact O-CB 3.3Å; Y153-K157 PolarHBondContact O-N 3.38Å; E154-K157 WeakPolarHBondContact OE1-CD 3.44Å; E154-K157 WeakPolarHBondContact OE1-CE 3.39Å; E154-K157 IonicContact OE1-NZ 2.69Å; E154-K157 PolarHBondContact OE1-NZ 2.58Å
158	R	96.5	Very high	96.2	Very high	180 Å²	180	63.1 Å²	63.1	68%	0.679	30%	0.298	S	S	*	.	H	α-helix	trans	-92.6	-30.1	178.8	-64.3	165.8	-162.5	-161.8	4.9	113.8	E154 A155 H156	E154-R158 WeakPolarHBondContact O-CB 3.05Å; E154-R158 VanDerWaalsContact O-CD 3.24Å; E154-R158 WeakPolarHBondContact O-CD 3.34Å; E154-R158 WeakPolarHBondContact O-CG 3.38Å; E154-R158 PolarHBondContact O-N 3.36Å; E154-R158 PolarHBondContact O-NE 3.18Å; E154-R158 IonicContact OE2-CZ 2.82Å; E154-R158 VanDerWaalsContact OE2-CZ 3.24Å; E154-R158 IonicContact OE2-NE 2.71Å; E154-R158 PolarHBondContact OE2-NE 3.15Å; E154-R158 IonicContact OE2-NH2 3.12Å; E154-R158 PolarHBondContact OE2-NH2 3.15Å; A155-R158 PolarHBondContact O-N 3.39Å; H156-R158 PolarHBondContact O-N 3.06Å
159	L	96.2	Very high	96.2	Very high	47 Å²	47	66.7 Å²	66.7	25%	0.246	32%	0.317	C	S	.	.	H	α-helix	trans	-117.2	-14.4	-169	-56.2	176.5	0	0	0	114.3	A155 H156 R162 E165 I166	A155-L159 WeakPolarHBondContact O-CA 3.31Å; A155-L159 WeakPolarHBondContact O-CB 3.47Å; A155-L159 WeakPolarHBondContact O-CG 3.42Å; A155-L159 PolarHBondContact O-N 3.28Å; H156-L159 PolarHBondContact O-N 3.37Å; L159-R162 HydrophobicContact CB-CB 4.22Å; L159-R162 WeakPolarHBondContact O-CG 3.3Å; L159-R162 PolarHBondContact O-NE 3.5Å; L159-R162 PolarHBondContact O-NH2 2.99Å; L159-E165 HydrophobicContact CD1-CB 4.18Å; L159-E165 HydrophobicContact CD1-CG 3.99Å; L159-I166 HydrophobicContact CD1-CG1 4.14Å
160	G	95.3	Very high	96.2	Very high	28 Å²	28	66.5 Å²	66.5	29%	0.289	32%	0.316	S	S	.	.	S	Bend	trans	63.5	-148.8	-169.3	0	0	0	0	0	112.2	H156 R162	H156-G160 PolarHBondContact CD2-O 3.26Å; H156-G160 VanDerWaalsContact CD2-O 3.31Å; H156-G160 WeakPolarHBondContact O-CA 3.28Å; H156-G160 PolarHBondContact O-N 3.09Å; G160-R162 PolarHBondContact O-N 3.09Å
161	N	96.6	Very high	96.1	Very high	113 Å²	113	66.5 Å²	66.5	60%	0.604	33%	0.328	S	S	*	.	S	Bend	trans	-71.4	28.7	-177.8	-62.6	-25.4	0	0	0	114.6	H156 W163	H156-N161 PolarHBondContact NE2-OD1 3.44Å; N161-W163 HydrophobicContact CB-CZ2 4.02Å; N161-W163 PolarHBondContact O-N 2.91Å; N161-W163 PolarHBondContact O-NE1 3.42Å; N161-W163 VanDerWaalsContact OD1-CZ2 3.32Å; N161-W163 WeakPolarHBondContact OD1-CZ2 3.19Å
162	R	97.1	Very high	95.9	Very high	146 Å²	146	64.4 Å²	64.4	55%	0.551	32%	0.323	S	S	*	.			trans	-81	61.1	177	-76.3	-173.6	-84.7	178.8	-8.1	111.2	L159 G160 A164 E165 I166	L159-R162 HydrophobicContact CB-CB 4.22Å; L159-R162 WeakPolarHBondContact O-CG 3.3Å; L159-R162 PolarHBondContact O-NE 3.5Å; L159-R162 PolarHBondContact O-NH2 2.99Å; G160-R162 PolarHBondContact O-N 3.09Å; R162-A164 VanDerWaalsContact C-N 3.29Å; R162-A164 PolarHBondContact O-N 2.7Å; R162-E165 HydrophobicContact CB-CB 4.08Å; R162-E165 WeakPolarHBondContact O-CA 3.33Å; R162-E165 WeakPolarHBondContact O-CB 3.16Å; R162-E165 PolarHBondContact O-N 2.84Å; R162-I166 PolarHBondContact O-N 2.76Å; R162-I166 VanDerWaalsContact O-N 3.08Å
163	W	97.2	Very high	95.9	Very high	35 Å²	35	65.2 Å²	65.2	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-54.4	-38.5	-171.9	-52.3	116.7	0	0	0	114.5	H156 N161 E165 I166 S167 D175 I178 K179 W182	H156-W163 AromaticContact CD2-CH2 3.36Å; H156-W163 WeakPolarHBondContact CD2-CH2 3.44Å; H156-W163 AromaticContact CD2-CZ3 3.71Å; H156-W163 AromaticContact NE2-CH2 3.68Å; N161-W163 HydrophobicContact CB-CZ2 4.02Å; N161-W163 PolarHBondContact O-N 2.91Å; N161-W163 PolarHBondContact O-NE1 3.42Å; N161-W163 VanDerWaalsContact OD1-CZ2 3.32Å; N161-W163 WeakPolarHBondContact OD1-CZ2 3.19Å; W163-E165 PolarHBondContact O-N 2.69Å; W163-I166 HydrophobicContact CE3-CD1 3.96Å; W163-I166 HydrophobicContact CZ3-CD1 4.14Å; W163-I166 PolarHBondContact O-N 2.9Å; W163-S167 WeakPolarHBondContact O-CB 3.16Å; W163-S167 PolarHBondContact O-N 3.06Å; W163-S167 PolarHBondContact O-OG 3.09Å; W163-D175 HydrophobicContact CB-CB 3.89Å; W163-I178 HydrophobicContact CE3-CG2 3.86Å; W163-I178 HydrophobicContact CZ3-CG2 4.14Å; W163-K179 HydrophobicContact CD2-CB 3.74Å; W163-K179 HydrophobicContact CD2-CG 4.27Å; W163-K179 HydrophobicContact CE3-CB 4.27Å; W163-K179 HydrophobicContact CG-CB 3.82Å; W163-K179 HydrophobicContact CG-CG 4.35Å; W163-K179 HydrophobicContact CZ2-CG 4.42Å; W163-W182 HydrophobicContact CH2-CB 3.75Å; W163-W182 AromaticContact CH2-CD1 3.57Å; W163-W182 HydrophobicContact CH2-CD2 4.22Å; W163-W182 AromaticContact CH2-CG 3.54Å; W163-W182 HydrophobicContact CH2-CG 3.54Å; W163-W182 HydrophobicContact CZ3-CB 3.96Å; W163-W182 HydrophobicContact CZ3-CG 4.11Å
164	A	96.8	Very high	96	Very high	61 Å²	61	63.3 Å²	63.3	50%	0.504	32%	0.321	S	S	.	.	H	α-helix	trans	-74.1	-9.9	177.4	0	0	0	0	0	114.6	R162 S167 K168 D175	R162-A164 VanDerWaalsContact C-N 3.29Å; R162-A164 PolarHBondContact O-N 2.7Å; A164-S167 WeakPolarHBondContact CA-OG 3.34Å; A164-S167 PolarHBondContact O-OG 2.92Å; A164-K168 WeakPolarHBondContact O-CE 3.47Å; A164-D175 HydrophobicContact CB-CB 4.24Å
165	E	97.3	Very high	96	Very high	83 Å²	83	64 Å²	64	39%	0.388	33%	0.326	S	S	.	.	H	α-helix	trans	-91.6	-43.4	168.5	-156.9	62.2	-137.2	0	0	109.9	L159 R162 W163 S167 K168	L159-E165 HydrophobicContact CD1-CB 4.18Å; L159-E165 HydrophobicContact CD1-CG 3.99Å; R162-E165 HydrophobicContact CB-CB 4.08Å; R162-E165 WeakPolarHBondContact O-CA 3.33Å; R162-E165 WeakPolarHBondContact O-CB 3.16Å; R162-E165 PolarHBondContact O-N 2.84Å; W163-E165 PolarHBondContact O-N 2.69Å; E165-S167 VanDerWaalsContact C-N 3.28Å; E165-S167 PolarHBondContact O-N 2.9Å; E165-K168 WeakPolarHBondContact O-CB 3.46Å; E165-K168 PolarHBondContact O-N 3.13Å; E165-K168 VanDerWaalsContact O-N 3.12Å; E165-K168 WeakPolarHBondContact OE1-CD 3.4Å; E165-K168 WeakPolarHBondContact OE1-CE 2.98Å; E165-K168 IonicContact OE1-NZ 3.65Å; E165-K168 PolarHBondContact OE1-NZ 3.19Å; E165-K168 WeakPolarHBondContact OE2-CE 3.46Å; E165-K168 IonicContact OE2-NZ 3.97Å; E165-K168 PolarHBondContact OE2-NZ 3.36Å
166	I	97	Very high	96	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-37.2	176	-59	171.7	0	0	0	111.1	A155 H156 L159 R162 W163 K168 L169 L170 I178	A155-I166 HydrophobicContact CB-CB 4.41Å; A155-I166 HydrophobicContact CB-CD1 4.49Å; A155-I166 HydrophobicContact CB-CG1 3.93Å; A155-I166 HydrophobicContact CB-CG2 3.93Å; H156-I166 HydrophobicContact CB-CD1 4.26Å; L159-I166 HydrophobicContact CD1-CG1 4.14Å; R162-I166 PolarHBondContact O-N 2.76Å; R162-I166 VanDerWaalsContact O-N 3.08Å; W163-I166 HydrophobicContact CE3-CD1 3.96Å; W163-I166 HydrophobicContact CZ3-CD1 4.14Å; W163-I166 PolarHBondContact O-N 2.9Å; I166-K168 PolarHBondContact O-N 3.36Å; I166-L169 WeakPolarHBondContact O-CB 3.42Å; I166-L169 PolarHBondContact O-N 3.19Å; I166-L170 HydrophobicContact CG2-CD1 3.98Å; I166-I178 HydrophobicContact CG2-CD1 4.45Å; I166-I178 HydrophobicContact CG2-CG2 3.97Å
167	S	96.9	Very high	96	Very high	28 Å²	28	65.1 Å²	65.1	20%	0.196	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-62.6	-23.7	177	62.4	0	0	0	0	114.2	W163 A164 E165 L169 L170 I178	W163-S167 WeakPolarHBondContact O-CB 3.16Å; W163-S167 PolarHBondContact O-N 3.06Å; W163-S167 PolarHBondContact O-OG 3.09Å; A164-S167 WeakPolarHBondContact CA-OG 3.34Å; A164-S167 PolarHBondContact O-OG 2.92Å; E165-S167 VanDerWaalsContact C-N 3.28Å; E165-S167 PolarHBondContact O-N 2.9Å; S167-L169 PolarHBondContact O-N 3.3Å; S167-L170 PolarHBondContact O-N 3.25Å; S167-I178 VanDerWaalsContact CA-CD1 3.42Å
168	K	96.4	Very high	96.1	Very high	135 Å²	135	59 Å²	59	59%	0.587	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-69.2	-22	175.2	-54.7	180	-165.5	166.8	0	112.5	A164 E165 I166	A164-K168 WeakPolarHBondContact O-CE 3.47Å; E165-K168 WeakPolarHBondContact O-CB 3.46Å; E165-K168 PolarHBondContact O-N 3.13Å; E165-K168 VanDerWaalsContact O-N 3.12Å; E165-K168 WeakPolarHBondContact OE1-CD 3.4Å; E165-K168 WeakPolarHBondContact OE1-CE 2.98Å; E165-K168 IonicContact OE1-NZ 3.65Å; E165-K168 PolarHBondContact OE1-NZ 3.19Å; E165-K168 WeakPolarHBondContact OE2-CE 3.46Å; E165-K168 IonicContact OE2-NZ 3.97Å; E165-K168 PolarHBondContact OE2-NZ 3.36Å; I166-K168 PolarHBondContact O-N 3.36Å
169	L	95.8	Very high	96.1	Very high	93 Å²	93	53.6 Å²	53.6	49%	0.487	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-86.7	-8.4	177.7	-53	175.9	0	0	0	112.7	I151 A155 I166 S167	I151-L169 HydrophobicContact CG2-CB 3.8Å; I151-L169 HydrophobicContact CG2-CD1 4.47Å; A155-L169 HydrophobicContact CB-CD1 3.67Å; I166-L169 WeakPolarHBondContact O-CB 3.42Å; I166-L169 PolarHBondContact O-N 3.19Å; S167-L169 PolarHBondContact O-N 3.3Å
170	L	95.5	Very high	96.1	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.299	C	S	.	.	S	Bend	trans	-128.6	75.2	-169.5	-69.8	161	0	0	0	109.7	E148 I151 I152 I166 S167 G172 R173 I178	E148-L170 HydrophobicContact CB-CD2 3.91Å; E148-L170 HydrophobicContact CG-CD2 3.88Å; I151-L170 HydrophobicContact CB-CD2 3.94Å; I151-L170 HydrophobicContact CD1-CD2 4.13Å; I151-L170 HydrophobicContact CG2-CD1 4.23Å; I151-L170 HydrophobicContact CG2-CD2 3.74Å; I151-L170 HydrophobicContact CG2-CG 3.81Å; I152-L170 HydrophobicContact CD1-CD1 4.16Å; I152-L170 HydrophobicContact CG1-CD1 3.44Å; I152-L170 VanDerWaalsContact CG1-CD1 3.44Å; I166-L170 HydrophobicContact CG2-CD1 3.98Å; S167-L170 PolarHBondContact O-N 3.25Å; L170-G172 PolarHBondContact O-N 2.83Å; L170-G172 VanDerWaalsContact O-N 3.14Å; L170-R173 HydrophobicContact CB-CB 3.95Å; L170-R173 HydrophobicContact CB-CG 4.19Å; L170-R173 PolarHBondContact O-N 3.15Å; L170-I178 HydrophobicContact CB-CD1 4.25Å; L170-I178 HydrophobicContact CD1-CD1 3.59Å; L170-I178 HydrophobicContact CD1-CG1 3.9Å
171	P	93.4	Very high	96.1	Very high	94 Å²	94	54.5 Å²	54.5	61%	0.61	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	120.3	-171.4	22.2	-33.3	0	0	0	111.5	K140	K140-P171 WeakPolarHBondContact CD-O 3.49Å; K140-P171 WeakPolarHBondContact CE-O 3.46Å; K140-P171 PolarHBondContact NZ-O 3.12Å
172	G	92.6	Very high	96.1	Very high	24 Å²	24	50.1 Å²	50.1	25%	0.247	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	2.7	-176.5	0	0	0	0	0	115.6	E138 K140 L170	E138-G172 WeakPolarHBondContact O-CA 3.24Å; K140-G172 PolarHBondContact N-O 3.15Å; L170-G172 PolarHBondContact O-N 2.83Å; L170-G172 VanDerWaalsContact O-N 3.14Å
173	R	95.6	Very high	96	Very high	17 Å²	17	47.5 Å²	47.5	6%	0.064	26%	0.26	C	S	.	.			trans	-102.5	141.3	168	-58.5	-60.9	-169.2	170.9	13.8	110	K140 S142 S143 W144 E148 L170 I178	K140-R173 PolarHBondContact O-NH1 2.88Å; S142-R173 PolarHBondContact O-NH1 3.35Å; S142-R173 PolarHBondContact O-NH2 3.45Å; S142-R173 PolarHBondContact OG-NH2 2.93Å; S143-R173 PolarHBondContact O-NH2 3.12Å; W144-R173 HydrophobicContact CH2-CB 4.09Å; W144-R173 HydrophobicContact CH2-CG 3.94Å; W144-R173 HydrophobicContact CZ3-CB 4.22Å; W144-R173 HydrophobicContact CZ3-CG 3.67Å; E148-R173 WeakPolarHBondContact OE1-CG 3.47Å; E148-R173 IonicContact OE1-CZ 2.66Å; E148-R173 IonicContact OE1-NE 3.13Å; E148-R173 PolarHBondContact OE1-NE 3.49Å; E148-R173 IonicContact OE1-NH2 3.33Å; E148-R173 PolarHBondContact OE1-NH2 3.22Å; E148-R173 IonicContact OE2-CZ 2.96Å; E148-R173 IonicContact OE2-NE 3.16Å; E148-R173 IonicContact OE2-NH2 2.72Å; E148-R173 PolarHBondContact OE2-NH2 3.21Å; L170-R173 HydrophobicContact CB-CB 3.95Å; L170-R173 HydrophobicContact CB-CG 4.19Å; L170-R173 PolarHBondContact O-N 3.15Å; R173-I178 HydrophobicContact CB-CD1 4.1Å; R173-I178 HydrophobicContact CB-CG1 4.08Å
174	T	96.8	Very high	95.8	Very high	17 Å²	17	49 Å²	49	10%	0.104	28%	0.275	C	S	.	.			trans	-93.6	155.9	-178.3	75.1	0	0	0	0	110.7	H132 N133 V139 N176 S177 I178	H132-T174 VanDerWaalsContact O-CG2 3.32Å; H132-T174 WeakPolarHBondContact O-CG2 3.49Å; N133-T174 PolarHBondContact OD1-OG1 3.35Å; V139-T174 HydrophobicContact CG1-CG2 4.08Å; V139-T174 HydrophobicContact CG2-CG2 3.87Å; T174-N176 PolarHBondContact O-N 3.41Å; T174-S177 PolarHBondContact N-OG 2.98Å; T174-S177 PolarHBondContact O-N 3.49Å; T174-S177 VanDerWaalsContact O-N 3.07Å; T174-S177 PolarHBondContact O-OG 3.32Å; T174-S177 VanDerWaalsContact O-OG 3.04Å; T174-S177 PolarHBondContact OG1-N 2.99Å; T174-I178 WeakPolarHBondContact O-CD1 3.32Å; T174-I178 VanDerWaalsContact O-CG1 3.3Å; T174-I178 WeakPolarHBondContact O-CG1 3.27Å; T174-I178 PolarHBondContact O-N 2.85Å
175	D	96.3	Very high	95.4	Very high	70 Å²	70	48.2 Å²	48.2	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-54.4	-38.4	173.1	67.8	-60.4	0	0	0	111.1	W163 A164 K179	W163-D175 HydrophobicContact CB-CB 3.89Å; A164-D175 HydrophobicContact CB-CB 4.24Å; D175-K179 WeakPolarHBondContact O-CB 3.48Å; D175-K179 PolarHBondContact O-N 3.35Å
176	N	96.4	Very high	95.1	Very high	32 Å²	32	44.3 Å²	44.3	17%	0.171	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-43.4	175.1	-169.2	53.5	0	0	0	112.6	N133 T174 K179 N180	N133-N176 VanDerWaalsContact OD1-CB 3.24Å; N133-N176 WeakPolarHBondContact OD1-CB 3.37Å; T174-N176 PolarHBondContact O-N 3.41Å; N176-K179 WeakPolarHBondContact OD1-CE 3.48Å; N176-K179 PolarHBondContact OD1-NZ 2.91Å; N176-N180 WeakPolarHBondContact O-CB 3.34Å; N176-N180 PolarHBondContact O-N 3.17Å; N176-N180 PolarHBondContact O-ND2 3.03Å; N176-N180 PolarHBondContact O-OD1 2.91Å
177	S	96.4	Very high	94.5	Very high	32 Å²	32	50.2 Å²	50.2	22%	0.224	27%	0.269	C	S	.	.	H	α-helix	trans	-67	-40.6	179.5	73.2	0	0	0	0	111.6	W144 T174 N180 H181	W144-S177 WeakPolarHBondContact CZ2-O 3.22Å; T174-S177 PolarHBondContact N-OG 2.98Å; T174-S177 PolarHBondContact O-N 3.49Å; T174-S177 VanDerWaalsContact O-N 3.07Å; T174-S177 PolarHBondContact O-OG 3.32Å; T174-S177 VanDerWaalsContact O-OG 3.04Å; T174-S177 PolarHBondContact OG1-N 2.99Å; S177-N180 PolarHBondContact O-N 3.48Å; S177-H181 WeakPolarHBondContact O-CB 3.31Å; S177-H181 PolarHBondContact O-N 3.46Å
178	I	96.8	Very high	93.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-49.9	177.6	-64.4	158.2	0	0	0	110.8	W144 I152 W163 I166 S167 L170 R173 T174 N180 H181 W182	W144-I178 HydrophobicContact CH2-CG1 3.84Å; W144-I178 HydrophobicContact CZ3-CG1 4.35Å; I152-I178 HydrophobicContact CD1-CG2 4.1Å; I152-I178 HydrophobicContact CG1-CG2 3.96Å; I152-I178 HydrophobicContact CG2-CG2 4.06Å; W163-I178 HydrophobicContact CE3-CG2 3.86Å; W163-I178 HydrophobicContact CZ3-CG2 4.14Å; I166-I178 HydrophobicContact CG2-CD1 4.45Å; I166-I178 HydrophobicContact CG2-CG2 3.97Å; S167-I178 VanDerWaalsContact CA-CD1 3.42Å; L170-I178 HydrophobicContact CB-CD1 4.25Å; L170-I178 HydrophobicContact CD1-CD1 3.59Å; L170-I178 HydrophobicContact CD1-CG1 3.9Å; R173-I178 HydrophobicContact CB-CD1 4.1Å; R173-I178 HydrophobicContact CB-CG1 4.08Å; T174-I178 WeakPolarHBondContact O-CD1 3.32Å; T174-I178 VanDerWaalsContact O-CG1 3.3Å; T174-I178 WeakPolarHBondContact O-CG1 3.27Å; T174-I178 PolarHBondContact O-N 2.85Å; I178-N180 VanDerWaalsContact C-N 3.26Å; I178-N180 PolarHBondContact O-N 3.06Å; I178-H181 PolarHBondContact O-N 3.04Å; I178-W182 WeakPolarHBondContact O-CB 3.37Å; I178-W182 PolarHBondContact O-N 3.47Å
179	K	96.5	Very high	93.1	Very high	67 Å²	67	54 Å²	54	29%	0.291	28%	0.277	S	S	.	.	H	α-helix	trans	-54	-43.3	174	174.6	-163.1	71.4	-169.7	0	111.5	W163 D175 N176 N183	W163-K179 HydrophobicContact CD2-CB 3.74Å; W163-K179 HydrophobicContact CD2-CG 4.27Å; W163-K179 HydrophobicContact CE3-CB 4.27Å; W163-K179 HydrophobicContact CG-CB 3.82Å; W163-K179 HydrophobicContact CG-CG 4.35Å; W163-K179 HydrophobicContact CZ2-CG 4.42Å; D175-K179 WeakPolarHBondContact O-CB 3.48Å; D175-K179 PolarHBondContact O-N 3.35Å; N176-K179 WeakPolarHBondContact OD1-CE 3.48Å; N176-K179 PolarHBondContact OD1-NZ 2.91Å; K179-N183 PolarHBondContact O-N 2.74Å; K179-N183 PolarHBondContact O-ND2 3.22Å
180	N	96.1	Very high	92.2	Very high	81 Å²	81	51.3 Å²	51.3	43%	0.433	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-49.6	-178.8	-70	-0.7	0	0	0	111	N176 S177 I178 W182 N183 S184	N176-N180 WeakPolarHBondContact O-CB 3.34Å; N176-N180 PolarHBondContact O-N 3.17Å; N176-N180 PolarHBondContact O-ND2 3.03Å; N176-N180 PolarHBondContact O-OD1 2.91Å; S177-N180 PolarHBondContact O-N 3.48Å; I178-N180 VanDerWaalsContact C-N 3.26Å; I178-N180 PolarHBondContact O-N 3.06Å; N180-W182 VanDerWaalsContact C-N 3.32Å; N180-W182 PolarHBondContact O-N 2.91Å; N180-N183 PolarHBondContact O-N 3.03Å; N180-N183 VanDerWaalsContact O-N 3.15Å; N180-S184 PolarHBondContact O-N 3.19Å; N180-S184 PolarHBondContact O-OG 3.49Å; N180-S184 VanDerWaalsContact O-OG 3.09Å
181	H	95.4	Very high	91.2	Very high	12 Å²	12	57.1 Å²	57.1	6%	0.056	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-37.3	178.1	-179	54.8	0	0	0	113.2	W144 D149 S177 I178 N183 S184 T185 M186	W144-H181 AromaticContact CD1-CD2 4Å; W144-H181 AromaticContact CD1-CE1 3.57Å; W144-H181 AromaticContact CD1-CG 3.71Å; W144-H181 AromaticContact CD1-ND1 3.46Å; W144-H181 AromaticContact CD1-NE2 3.91Å; W144-H181 HydrophobicContact CD2-CB 4.33Å; W144-H181 AromaticContact CD2-CD2 3.55Å; W144-H181 AromaticContact CD2-CG 3.84Å; W144-H181 AromaticContact CD2-NE2 3.84Å; W144-H181 AromaticContact CE2-CD2 3.74Å; W144-H181 AromaticContact CE2-CG 3.57Å; W144-H181 AromaticContact CE3-CD2 3.94Å; W144-H181 AromaticContact CG-CD2 3.75Å; W144-H181 AromaticContact CG-CE1 3.64Å; W144-H181 AromaticContact CG-CG 3.93Å; W144-H181 AromaticContact CG-ND1 3.9Å; W144-H181 AromaticContact CG-NE2 3.55Å; W144-H181 HydrophobicContact CH2-CB 4.41Å; W144-H181 HydrophobicContact CZ2-CB 3.65Å; W144-H181 AromaticContact NE1-CD2 4Å; W144-H181 AromaticContact NE1-CG 3.49Å; W144-H181 AromaticContact NE1-ND1 3.63Å; D149-H181 IonicContact OD1-CD2 3.47Å; D149-H181 IonicContact OD1-CE1 3.31Å; D149-H181 IonicContact OD1-NE2 2.7Å; D149-H181 PolarHBondContact OD1-NE2 3.06Å; D149-H181 IonicContact OD2-NE2 2.74Å; S177-H181 WeakPolarHBondContact O-CB 3.31Å; S177-H181 PolarHBondContact O-N 3.46Å; I178-H181 PolarHBondContact O-N 3.04Å; H181-N183 PolarHBondContact O-N 3.31Å; H181-S184 WeakPolarHBondContact CA-OG 3.45Å; H181-S184 PolarHBondContact O-OG 3Å; H181-T185 WeakPolarHBondContact ND1-CB 3.34Å; H181-T185 PolarHBondContact ND1-OG1 3.22Å; H181-T185 WeakPolarHBondContact O-CA 3.4Å; H181-T185 VanDerWaalsContact O-CB 3.25Å; H181-T185 WeakPolarHBondContact O-CB 3.38Å; H181-T185 PolarHBondContact O-N 3.21Å; H181-T185 PolarHBondContact O-OG1 3.28Å; H181-M186 PolarHBondContact O-N 3.3Å; H181-M186 VanDerWaalsContact O-N 3.11Å
182	W	95.8	Very high	89.6	Confident	22 Å²	22	60.7 Å²	60.7	8%	0.083	30%	0.299	C	S	.	.	I	π-helix	trans	-57.8	-49.6	172.6	178.5	-96.3	0	0	0	111.8	I152 Y153 H156 W163 I178 N180 M186 R187 V190	I152-W182 HydrophobicContact CG2-CE3 3.87Å; I152-W182 HydrophobicContact CG2-CZ3 4.47Å; Y153-W182 HydrophobicContact CD2-CH2 4.39Å; Y153-W182 HydrophobicContact CD2-CZ3 4.45Å; H156-W182 HydrophobicContact CB-CH2 4.28Å; H156-W182 HydrophobicContact CB-CZ3 4.19Å; H156-W182 AromaticContact CE1-CE2 3.81Å; H156-W182 AromaticContact CE1-CZ2 3.55Å; H156-W182 AromaticContact CG-CH2 3.99Å; H156-W182 AromaticContact CG-CZ2 3.93Å; H156-W182 AromaticContact ND1-CE2 3.92Å; H156-W182 AromaticContact ND1-CH2 3.62Å; H156-W182 AromaticContact ND1-CZ2 3.39Å; H156-W182 WeakPolarHBondContact ND1-CZ2 3.46Å; H156-W182 AromaticContact NE2-CE2 3.97Å; H156-W182 AromaticContact NE2-NE1 3.95Å; W163-W182 HydrophobicContact CH2-CB 3.75Å; W163-W182 AromaticContact CH2-CD1 3.57Å; W163-W182 HydrophobicContact CH2-CD2 4.22Å; W163-W182 AromaticContact CH2-CG 3.54Å; W163-W182 HydrophobicContact CH2-CG 3.54Å; W163-W182 HydrophobicContact CZ3-CB 3.96Å; W163-W182 HydrophobicContact CZ3-CG 4.11Å; I178-W182 WeakPolarHBondContact O-CB 3.37Å; I178-W182 PolarHBondContact O-N 3.47Å; N180-W182 VanDerWaalsContact C-N 3.32Å; N180-W182 PolarHBondContact O-N 2.91Å; W182-M186 HydrophobicContact CD2-CB 4.3Å; W182-M186 HydrophobicContact CE3-CB 3.67Å; W182-M186 HydrophobicContact CE3-CG 4.33Å; W182-M186 HydrophobicContact CE3-SD 3.98Å; W182-M186 HydrophobicContact CZ3-CB 4.08Å; W182-M186 HydrophobicContact CZ3-SD 4.37Å; W182-M186 PolarHBondContact O-N 2.69Å; W182-R187 WeakPolarHBondContact O-CB 3.35Å; W182-R187 PolarHBondContact O-N 3.49Å; W182-V190 HydrophobicContact CH2-CG2 4.48Å; W182-V190 HydrophobicContact CZ3-CG2 4.42Å
183	N	94.6	Very high	88	Confident	91 Å²	91	65.7 Å²	65.7	49%	0.487	32%	0.316	S	S	.	.	I	π-helix	trans	-75.9	-35.4	-175.8	-72	-62.9	0	0	0	113.5	K179 N180 H181	K179-N183 PolarHBondContact O-N 2.74Å; K179-N183 PolarHBondContact O-ND2 3.22Å; N180-N183 PolarHBondContact O-N 3.03Å; N180-N183 VanDerWaalsContact O-N 3.15Å; H181-N183 PolarHBondContact O-N 3.31Å
184	S	92.4	Very high	86.5	Confident	65 Å²	65	66.3 Å²	66.3	46%	0.455	33%	0.328	S	S	.	.	I	π-helix	trans	-75.4	-45.1	177.6	59.7	0	0	0	0	112.4	N180 H181 R188	N180-S184 PolarHBondContact O-N 3.19Å; N180-S184 PolarHBondContact O-OG 3.49Å; N180-S184 VanDerWaalsContact O-OG 3.09Å; H181-S184 WeakPolarHBondContact CA-OG 3.45Å; H181-S184 PolarHBondContact O-OG 3Å; S184-R188 PolarHBondContact O-NH2 3.22Å
185	T	90	Very high	84.9	Confident	46 Å²	46	69 Å²	69	28%	0.282	34%	0.337	S	S	.	.	I	π-helix	trans	-116.1	-59.2	-159.6	-37.4	0	0	0	0	111.6	H181 K189	H181-T185 WeakPolarHBondContact ND1-CB 3.34Å; H181-T185 PolarHBondContact ND1-OG1 3.22Å; H181-T185 WeakPolarHBondContact O-CA 3.4Å; H181-T185 VanDerWaalsContact O-CB 3.25Å; H181-T185 WeakPolarHBondContact O-CB 3.38Å; H181-T185 PolarHBondContact O-N 3.21Å; H181-T185 PolarHBondContact O-OG1 3.28Å; T185-K189 WeakPolarHBondContact O-CG 3.29Å
186	M	89.9	Confident	83.4	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.326	C	S	.	.	I	π-helix	trans	-73.3	-45	-164.9	-61.1	-158	72.2	0	0	113.4	D149 I152 H181 W182 R188 K189 V190 L196	D149-M186 HydrophobicContact CB-CE 3.67Å; D149-M186 HydrophobicContact CB-SD 4.33Å; D149-M186 WeakPolarHBondContact O-CE 3.44Å; I152-M186 HydrophobicContact CB-SD 3.78Å; I152-M186 HydrophobicContact CD1-SD 4.24Å; I152-M186 HydrophobicContact CG2-SD 3.56Å; I152-M186 VanDerWaalsContact CG2-SD 3.56Å; H181-M186 PolarHBondContact O-N 3.3Å; H181-M186 VanDerWaalsContact O-N 3.11Å; W182-M186 HydrophobicContact CD2-CB 4.3Å; W182-M186 HydrophobicContact CE3-CB 3.67Å; W182-M186 HydrophobicContact CE3-CG 4.33Å; W182-M186 HydrophobicContact CE3-SD 3.98Å; W182-M186 HydrophobicContact CZ3-CB 4.08Å; W182-M186 HydrophobicContact CZ3-SD 4.37Å; W182-M186 PolarHBondContact O-N 2.69Å; M186-R188 VanDerWaalsContact C-N 3.34Å; M186-R188 PolarHBondContact O-N 3.3Å; M186-K189 PolarHBondContact O-N 3.28Å; M186-V190 HydrophobicContact CB-CG2 4.46Å; M186-V190 HydrophobicContact CE-CG2 4.41Å; M186-V190 WeakPolarHBondContact O-CB 3.32Å; M186-V190 WeakPolarHBondContact O-CG2 3.44Å; M186-V190 PolarHBondContact O-N 3.43Å; M186-L196 HydrophobicContact CE-CD1 3.63Å
187	R	85.7	Confident	81.7	Confident	125 Å²	125	73 Å²	73	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-50.1	-51.8	-169.1	-178.7	175.5	177.7	-175.8	-2.9	112.6	W182 E191	W182-R187 WeakPolarHBondContact O-CB 3.35Å; W182-R187 PolarHBondContact O-N 3.49Å; R187-E191 WeakPolarHBondContact CG-OE1 3.35Å; R187-E191 IonicContact CZ-OE1 3.97Å; R187-E191 IonicContact NE-OE1 2.74Å; R187-E191 PolarHBondContact NE-OE1 2.84Å; R187-E191 IonicContact NE-OE2 3.7Å; R187-E191 IonicContact NH2-OE1 2.7Å; R187-E191 WeakPolarHBondContact O-CB 3.06Å; R187-E191 WeakPolarHBondContact O-CG 3.12Å; R187-E191 PolarHBondContact O-N 3.27Å
188	R	82.9	Confident	79.8	Confident	173 Å²	173	78.7 Å²	78.7	65%	0.653	38%	0.381	S	S	*	.	H	α-helix	trans	-67.5	-38.1	179.3	-69.1	178	-69.5	149.6	1.1	113.2	S184 M186 E191 H192	S184-R188 PolarHBondContact O-NH2 3.22Å; M186-R188 VanDerWaalsContact C-N 3.34Å; M186-R188 PolarHBondContact O-N 3.3Å; R188-E191 PolarHBondContact O-N 3.29Å; R188-H192 WeakPolarHBondContact O-CB 3.5Å; R188-H192 PolarHBondContact O-N 3.14Å
189	K	79.7	Confident	77.6	Confident	70 Å²	70	81.4 Å²	81.4	30%	0.304	41%	0.409	S	S	.	.	H	α-helix	trans	-67.7	-40.3	177.9	-66.5	-166.8	169.6	-165.2	0	112.6	T185 M186 E193 Y195	T185-K189 WeakPolarHBondContact O-CG 3.29Å; M186-K189 PolarHBondContact O-N 3.28Å; K189-E193 VanDerWaalsContact CG-OE2 3.3Å; K189-E193 WeakPolarHBondContact CG-OE2 3.34Å; K189-E193 WeakPolarHBondContact O-CB 3.29Å; K189-E193 PolarHBondContact O-N 2.94Å; K189-Y195 HydrophobicContact CB-CD1 4.24Å; K189-Y195 HydrophobicContact CB-CG 4.17Å; K189-Y195 HydrophobicContact CD-CD1 4.09Å; K189-Y195 HydrophobicContact CD-CD2 4.46Å; K189-Y195 HydrophobicContact CD-CE1 4.21Å; K189-Y195 HydrophobicContact CD-CG 4.23Å
190	V	77.8	Confident	75.1	Confident	35 Å²	35	81.6 Å²	81.6	21%	0.212	43%	0.43	C	S	.	.	H	α-helix	trans	-65.6	-42.8	175	168.4	0	0	0	0	110.8	Y153 W182 M186	Y153-V190 HydrophobicContact CD2-CB 4.48Å; Y153-V190 HydrophobicContact CD2-CG1 3.73Å; Y153-V190 HydrophobicContact CD2-CG2 3.83Å; Y153-V190 HydrophobicContact CE2-CG1 3.44Å; Y153-V190 VanDerWaalsContact CE2-CG1 3.44Å; Y153-V190 HydrophobicContact CE2-CG2 4.34Å; W182-V190 HydrophobicContact CH2-CG2 4.48Å; W182-V190 HydrophobicContact CZ3-CG2 4.42Å; M186-V190 HydrophobicContact CB-CG2 4.46Å; M186-V190 HydrophobicContact CE-CG2 4.41Å; M186-V190 WeakPolarHBondContact O-CB 3.32Å; M186-V190 WeakPolarHBondContact O-CG2 3.44Å; M186-V190 PolarHBondContact O-N 3.43Å
191	E	74.1	Confident	72.8	Confident	126 Å²	126	86 Å²	86	59%	0.589	45%	0.445	S	S	*	.	H	α-helix	trans	-71.1	-29.1	178.8	-72.3	164.6	-178.8	0	0	113	R187 R188	R187-E191 WeakPolarHBondContact CG-OE1 3.35Å; R187-E191 IonicContact CZ-OE1 3.97Å; R187-E191 IonicContact NE-OE1 2.74Å; R187-E191 PolarHBondContact NE-OE1 2.84Å; R187-E191 IonicContact NE-OE2 3.7Å; R187-E191 IonicContact NH2-OE1 2.7Å; R187-E191 WeakPolarHBondContact O-CB 3.06Å; R187-E191 WeakPolarHBondContact O-CG 3.12Å; R187-E191 PolarHBondContact O-N 3.27Å; R188-E191 PolarHBondContact O-N 3.29Å
192	H	60.5	Low	70	Confident	170 Å²	170	90.2 Å²	90.2	79%	0.787	48%	0.476	S	S	*	.	H	α-helix	trans	-127.7	-19.2	-163.3	-151.6	-56.3	0	0	0	117.2	R188	R188-H192 WeakPolarHBondContact O-CB 3.5Å; R188-H192 PolarHBondContact O-N 3.14Å
193	E	57.8	Low	67.5	Low	128 Å²	128	98.6 Å²	98.6	60%	0.598	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-6.7	-175.2	-66.2	-175.2	133.3	0	0	114.2	K189 Y195	K189-E193 VanDerWaalsContact CG-OE2 3.3Å; K189-E193 WeakPolarHBondContact CG-OE2 3.34Å; K189-E193 WeakPolarHBondContact O-CB 3.29Å; K189-E193 PolarHBondContact O-N 2.94Å; E193-Y195 PolarHBondContact O-N 3.37Å
194	G	63.8	Low	64.8	Low	30 Å²	30	100.1 Å²	100.1	31%	0.309	53%	0.526	S	S	.	.			trans	62.6	19.5	-167.2	0	0	0	0	0	112.6	L196 Q197	G194-L196 PolarHBondContact O-N 2.92Å; G194-Q197 WeakPolarHBondContact O-CB 3.33Å; G194-Q197 PolarHBondContact O-N 2.73Å
195	Y	63.3	Low	62.6	Low	75 Å²	75	102.8 Å²	102.8	29%	0.294	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	125.9	179.9	-163	-110.3	0	0	0	109.1	K189 E193	K189-Y195 HydrophobicContact CB-CD1 4.24Å; K189-Y195 HydrophobicContact CB-CG 4.17Å; K189-Y195 HydrophobicContact CD-CD1 4.09Å; K189-Y195 HydrophobicContact CD-CD2 4.46Å; K189-Y195 HydrophobicContact CD-CE1 4.21Å; K189-Y195 HydrophobicContact CD-CG 4.23Å; E193-Y195 PolarHBondContact O-N 3.37Å
196	L	65.8	Low	60.1	Low	28 Å²	28	106.3 Å²	106.3	15%	0.147	57%	0.571	C	S	.	*	T	Hydrogen-bonded Turn	trans	75.6	6.5	-174.2	-37.8	173.1	0	0	0	116.8	Q146 D149 R150 Y153 M186 G194 D198	Q146-L196 HydrophobicContact CG-CD2 3.57Å; D149-L196 HydrophobicContact CB-CD1 3.94Å; D149-L196 HydrophobicContact CB-CD2 4.28Å; D149-L196 WeakPolarHBondContact O-CD1 3.39Å; R150-L196 HydrophobicContact CG-CB 4.33Å; R150-L196 HydrophobicContact CG-CD1 4.4Å; R150-L196 HydrophobicContact CG-CD2 3.95Å; R150-L196 HydrophobicContact CG-CG 4.45Å; Y153-L196 HydrophobicContact CG-CD1 4.45Å; M186-L196 HydrophobicContact CE-CD1 3.63Å; G194-L196 PolarHBondContact O-N 2.92Å; L196-D198 PolarHBondContact O-N 3.11Å; L196-D198 VanDerWaalsContact O-N 3.09Å
197	Q	60.2	Low	57.8	Low	158 Å²	158	109.9 Å²	109.9	74%	0.738	61%	0.608	S	S	*	*			trans	-70.3	102.5	159.8	-68.4	-170.8	9.1	0	0	108.5	G194	G194-Q197 WeakPolarHBondContact O-CB 3.33Å; G194-Q197 PolarHBondContact O-N 2.73Å
198	D	56.5	Low	55.6	Low	150 Å²	150	112 Å²	112	80%	0.802	63%	0.629	S	S	*	*			trans	-63.9	146.6	-179.1	-155.8	-12.7	0	0	0	111	L196 G200	L196-D198 PolarHBondContact O-N 3.11Å; L196-D198 VanDerWaalsContact O-N 3.09Å; D198-G200 PolarHBondContact O-N 3.39Å
199	G	49.9	Very low	53.4	Low	57 Å²	57	106.9 Å²	106.9	59%	0.588	63%	0.63	S	S	*	*			trans	-74.7	68.3	-169.2	0	0	0	0	0	112.8	K201	G199-K201 PolarHBondContact O-N 2.99Å
200	G	44.4	Very low	51.5	Low	71 Å²	71	113.5 Å²	113.5	73%	0.732	66%	0.658	S	S	*	*			trans	-62.9	67.8	179.8	0	0	0	0	0	114	D198 S202	D198-G200 PolarHBondContact O-N 3.39Å; G200-S202 PolarHBondContact O-N 2.82Å
201	K	48.2	Very low	49.6	Very low	174 Å²	174	123.2 Å²	123.2	76%	0.757	69%	0.691	S	S	*	*			trans	-71.8	67	173.4	-70.2	178.6	-179.6	173.3	0	110.7	G199 F203	G199-K201 PolarHBondContact O-N 2.99Å; K201-F203 HydrophobicContact CB-CE2 4.44Å; K201-F203 VanDerWaalsContact O-CD2 3.31Å; K201-F203 WeakPolarHBondContact O-CD2 3.49Å; K201-F203 PolarHBondContact O-N 3.02Å
202	S	37.1	Very low	47.8	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	71%	0.707	S	S	*	*			trans	-58.6	108.9	157.5	-68.2	0	0	0	0	107.8	G200 T204	G200-S202 PolarHBondContact O-N 2.82Å; S202-T204 PolarHBondContact O-N 2.72Å
203	F	43.3	Very low	46.6	Very low	198 Å²	198	127 Å²	127	87%	0.868	70%	0.703	S	S	*	*			trans	-72	65.5	178.5	-83.2	-96.3	0	0	0	111.2	K201 S205	K201-F203 HydrophobicContact CB-CE2 4.44Å; K201-F203 VanDerWaalsContact O-CD2 3.31Å; K201-F203 WeakPolarHBondContact O-CD2 3.49Å; K201-F203 PolarHBondContact O-N 3.02Å; F203-S205 PolarHBondContact O-N 3Å
204	T	38.5	Very low	45.5	Very low	124 Å²	124	126.1 Å²	126.1	76%	0.761	71%	0.711	S	S	*	*			trans	-77	78.3	168.5	54.9	0	0	0	0	109.4	S202 S206	S202-T204 PolarHBondContact O-N 2.72Å; T204-S206 PolarHBondContact O-N 3.42Å
205	S	44.7	Very low	44	Very low	121 Å²	121	136 Å²	136	85%	0.846	74%	0.739	S	S	*	*			trans	-60	99.4	167.5	165	0	0	0	0	110	F203	F203-S205 PolarHBondContact O-N 3Å
206	S	37.9	Very low	42.7	Very low	119 Å²	119	138 Å²	138	83%	0.832	76%	0.764	S	S	*	*			trans	-152.2	100.3	163	-143.5	0	0	0	0	109.4	T204	T204-S206 PolarHBondContact O-N 3.42Å
207	G	41.5	Very low	41	Very low	76 Å²	76	142.6 Å²	142.6	78%	0.784	80%	0.798	S	S	*	*			trans	-87.2	144.3	-177.3	0	0	0	0	0	112.1
208	N	38.8	Very low	40.1	Very low	169 Å²	169	140.8 Å²	140.8	90%	0.904	80%	0.8	S	S	*	*			trans	-147.7	115.3	152.3	-136.6	-24.5	0	0	0	110.3
209	G	37.2	Very low	38.8	Very low	65 Å²	65	142 Å²	142	67%	0.67	81%	0.805	S	S	*	*			trans	-92.4	155	-171.5	0	0	0	0	0	113.6
210	K	39.9	Very low	38.2	Very low	209 Å²	209	145.6 Å²	145.6	91%	0.909	82%	0.816	S	S	*	*			trans	-134.4	109.6	161.8	-127.4	69.6	170.5	-174	0	110
211	R	39.1	Very low	38.2	Very low	240 Å²	240	147.7 Å²	147.7	91%	0.906	82%	0.816	S	S	*	*			trans	-74	131.2	176.6	-64.6	179	177	-175	-0.8	111.1
212	R	36.2	Very low	37.4	Very low	242 Å²	242	145.4 Å²	145.4	91%	0.913	82%	0.817	S	S	*	*			trans	-147.1	81.5	147.7	-68.7	-167.7	176.5	166.4	-0.5	107.5
213	N	34.8	Very low	37.2	Very low	132 Å²	132	147.9 Å²	147.9	71%	0.706	82%	0.823	S	S	*	*				63.1	86.1	84.8	-164.2	102.2	0	0	0	112.8
214	S	33.5	Very low	36.7	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	81%	0.812	S	S	*	*			trans	-57.1	145.7	165.1	42.7	0	0	0	0	111.8
215	R	33.9	Very low	36.7	Very low	236 Å²	236	145 Å²	145	89%	0.891	82%	0.816	S	S	*	*			trans	-124.7	122.5	163.4	-76.2	-175.1	174	-179.1	-2.7	107.8
216	S	34.6	Very low	36.1	Very low	118 Å²	118	150 Å²	150	83%	0.825	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.2	154.6	173.3	-52.1	0	0	0	0	110.8
217	C	30.8	Very low	35.7	Very low	125 Å²	125	150.3 Å²	150.3	85%	0.845	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73	152.3	175.2	-60.9	0	0	0	0	111.9
218	P	41.3	Very low	35.2	Very low	120 Å²	120	150 Å²	150	78%	0.779	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-88.5	149.7	177.7	35.3	-34.2	0	0	0	112.8
219	L	29.9	Very low	35	Very low	176 Å²	176	153.7 Å²	153.7	92%	0.921	82%	0.816	S	S	*	*			trans	-135.2	160.3	153.7	-79.5	179	0	0	0	109.6
220	T	37.1	Very low	34.9	Very low	132 Å²	132	155.5 Å²	155.5	81%	0.81	82%	0.818	S	S	*	*			trans	-83.8	163.5	-165.7	39.4	0	0	0	0	113.9
221	P	44.3	Very low	35.4	Very low	114 Å²	114	151.2 Å²	151.2	74%	0.74	81%	0.812	S	S	*	*			trans	-89.4	168.5	-162.2	36.8	-37.9	0	0	0	114.1
222	T	31.6	Very low	35.3	Very low	126 Å²	126	147.5 Å²	147.5	77%	0.773	81%	0.809	S	S	*	*			trans	-165.5	127.4	131.8	-72.7	0	0	0	0	110.8
223	D	32.5	Very low	36	Very low	153 Å²	153	141.4 Å²	141.4	82%	0.818	80%	0.801	S	S	*	*			trans	45.7	141.6	155.4	-71.5	-40.2	0	0	0	127.8
224	A	33.5	Very low	35.9	Very low	78 Å²	78	141.2 Å²	141.2	65%	0.645	80%	0.804	S	S	*	*			trans	83.4	119.3	135.2	0	0	0	0	0	123.2
225	Q	36.5	Very low	35.9	Very low	182 Å²	182	142.3 Å²	142.3	85%	0.85	81%	0.806	S	S	*	*			trans	59.5	129.4	132.6	-56.2	-175.7	35	0	0	119.6
226	R	33	Very low	35.7	Very low	228 Å²	228	135.7 Å²	135.7	86%	0.86	80%	0.802	S	S	*	*			cis	-173.2	168.6	26.1	-158.5	168.4	-168.6	-123.6	3.3	109.6
227	C	30.3	Very low	35.7	Very low	125 Å²	125	135.9 Å²	135.9	85%	0.845	80%	0.803	S	S	*	*			trans	-58.9	157.6	167.8	-46.6	0	0	0	0	112.6
228	G	30.5	Very low	35.9	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	79%	0.793	S	S	*	*			cis	143.9	174.1	-1.7	0	0	0	0	0	113
229	R	34.8	Very low	35.6	Very low	245 Å²	245	136.6 Å²	136.6	93%	0.925	79%	0.794	S	S	*	*			trans	74.6	124.5	169.4	-122.9	176.1	-172.9	-90.3	4.1	119.2
230	S	34.4	Very low	35.9	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	79%	0.792	S	S	*	*			trans	-75.5	-179.1	159.7	-12.1	0	0	0	0	111.3
231	P	51.4	Low	35.6	Very low	120 Å²	120	131.6 Å²	131.6	78%	0.779	78%	0.782	S	S	*	*			cis	-141.8	-170.8	23.5	42.1	-20.6	0	0	0	117.6
232	L	36.8	Very low	34.9	Very low	161 Å²	161	131.4 Å²	131.4	84%	0.843	78%	0.783	S	S	*	*			trans	-62.2	162.2	166.9	-51.5	168.4	0	0	0	111.9
233	P	49.9	Very low	34.8	Very low	114 Å²	114	134 Å²	134	74%	0.74	78%	0.784	S	S	*	*				-159.5	147.1	81.7	41.1	-19.7	0	0	0	120.5
234	V	32.5	Very low	34.8	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	77%	0.773	S	S	*	*				73.3	144.3	126.6	177.7	0	0	0	0	123.9
235	T	33.3	Very low	34.7	Very low	135 Å²	135	137.7 Å²	137.7	83%	0.828	78%	0.784	S	S	*	*			trans	67.6	125.5	161.9	40	0	0	0	0	123.3
236	A	31.7	Very low	34.7	Very low	97 Å²	97	135.5 Å²	135.5	80%	0.802	78%	0.779	S	S	*	*				-164.5	160.2	113.3	0	0	0	0	0	112.2
237	S	32.9	Very low	35.4	Very low	121 Å²	121	130.2 Å²	130.2	85%	0.846	77%	0.774	S	S	*	*			trans	-109.8	-174.7	165.5	-53.1	0	0	0	0	108.9
238	S	35.4	Very low	35.7	Very low	91 Å²	91	127.9 Å²	127.9	64%	0.636	76%	0.764	S	S	*	*			cis	-170.2	178.3	19.1	-158.9	0	0	0	0	110.8
239	Q	35.8	Very low	35.9	Very low	170 Å²	170	130.8 Å²	130.8	79%	0.794	77%	0.773	S	S	*	*			trans	68.8	150.4	156.7	-71.6	156.9	58.8	0	0	118
240	V	35.4	Very low	35.7	Very low	144 Å²	144	122.5 Å²	122.5	87%	0.873	76%	0.763	S	S	*	*			cis	-152.2	170.6	-1.7	-108.1	0	0	0	0	108.9
241	G	30.7	Very low	35.7	Very low	58 Å²	58	126.6 Å²	126.6	60%	0.598	77%	0.771	S	S	*	*			cis	159.3	10.4	-6	0	0	0	0	0	120.5
242	S	29.7	Very low	34.8	Very low	110 Å²	110	128 Å²	128	77%	0.769	77%	0.77	S	S	*	*			trans	-157.1	131.2	179.7	-76.9	0	0	0	0	112.7
243	F	29.5	Very low	34.8	Very low	181 Å²	181	128.8 Å²	128.8	79%	0.794	77%	0.773	S	S	*	*				73.3	136.3	69.2	-69.9	-60.3	0	0	0	114
244	S	33.2	Very low	34	Very low	85 Å²	85	131.2 Å²	131.2	59%	0.594	78%	0.78	S	S	*	*			cis	-174.3	179.6	-22.6	-123.7	0	0	0	0	111.6
245	Y	30.9	Very low	33.9	Very low	223 Å²	223	128.2 Å²	128.2	88%	0.875	78%	0.775	S	S	*	*			trans	96.1	125.3	158.9	-59	-72.2	0	0	0	120.8
246	D	35.6	Very low	33.8	Very low	137 Å²	137	129.8 Å²	129.8	73%	0.733	78%	0.778	S	S	*	*			trans	-99.2	151.7	163.5	173	41.5	0	0	0	107.6	A248	D246-A248 PolarHBondContact OD1-N 2.84Å
247	P	49.6	Very low	34.2	Very low	116 Å²	116	130 Å²	130	75%	0.753	77%	0.77	S	S	*	*				-151.7	127.3	98.7	35.6	-15.2	0	0	0	117.7
248	A	35.8	Very low	34.1	Very low	77 Å²	77	133.6 Å²	133.6	64%	0.636	77%	0.774	S	S	*	*			trans	74.8	162.5	130.4	0	0	0	0	0	122.7	D246	D246-A248 PolarHBondContact OD1-N 2.84Å
249	S	33.9	Very low	33.9	Very low	130 Å²	130	136.7 Å²	136.7	91%	0.909	78%	0.784	S	S	*	*			trans	72	143.9	-177	76.9	0	0	0	0	116.7
250	G	31.4	Very low	33.8	Very low	71 Å²	71	134 Å²	134	73%	0.732	78%	0.783	S	S	*	*			cis	175.5	123.6	-11	0	0	0	0	0	115.1
251	H	33.5	Very low	33.6	Very low	190 Å²	190	132.4 Å²	132.4	88%	0.88	78%	0.779	S	S	*	*			trans	74.7	150.5	161.7	-109.5	-76.9	0	0	0	121.8
252	I	33.6	Very low	33.5	Very low	149 Å²	149	138 Å²	138	76%	0.764	79%	0.787	S	S	*	*			trans	70.3	106.2	167.6	-55.2	166.7	0	0	0	117.2
253	I	35.7	Very low	34	Very low	177 Å²	177	138.9 Å²	138.9	91%	0.908	79%	0.787	S	S	*	*			trans	-135.3	137.4	144	44.7	172.2	0	0	0	108.2
254	D	33.8	Very low	33.9	Very low	166 Å²	166	134.3 Å²	134.3	89%	0.888	78%	0.778	S	S	*	*			trans	-132.1	156.3	174.9	-165	0.5	0	0	0	108.4
255	G	30.8	Very low	34.3	Very low	64 Å²	64	136 Å²	136	66%	0.66	79%	0.786	S	S	*	*			trans	92.1	95.8	-175.6	0	0	0	0	0	114.6
256	L	29.9	Very low	34.8	Very low	169 Å²	169	130.3 Å²	130.3	89%	0.885	78%	0.779	S	S	*	*			trans	-88.4	124.2	169.1	178.5	72.4	0	0	0	110.3
257	P	40.4	Very low	35	Very low	100 Å²	100	129.8 Å²	129.8	65%	0.649	79%	0.785	S	S	*	*			trans	-79.9	151.4	174.7	31.7	-34.9	0	0	0	113.1	N259	P257-N259 PolarHBondContact O-N 2.88Å
258	E	32.1	Very low	34.9	Very low	197 Å²	197	131.2 Å²	131.2	92%	0.921	79%	0.786	S	S	*	*			trans	-71.6	109.5	179.9	-59.9	-179.2	121.1	0	0	112.5	S260	E258-S260 PolarHBondContact O-N 3.2Å
259	N	31.3	Very low	35.3	Very low	157 Å²	157	135.2 Å²	135.2	84%	0.84	80%	0.796	S	S	*	*			trans	-92.7	89.1	171.7	-91.5	-19.1	0	0	0	111.9	P257 S261	P257-N259 PolarHBondContact O-N 2.88Å; N259-S261 PolarHBondContact O-N 3.35Å
260	S	32.6	Very low	36.4	Very low	113 Å²	113	133 Å²	133	79%	0.79	78%	0.775	S	S	*	*			trans	-56.9	128.5	165.9	-179.8	0	0	0	0	111.1	E258 F262	E258-S260 PolarHBondContact O-N 3.2Å; S260-F262 PolarHBondContact O-N 3.47Å
261	S	31.8	Very low	37.9	Very low	111 Å²	111	134.6 Å²	134.6	78%	0.776	77%	0.772	S	S	*	*			trans	-76.6	93.1	177.5	-69.1	0	0	0	0	110.8	N259 V263	N259-S261 PolarHBondContact O-N 3.35Å; S261-V263 PolarHBondContact O-N 3.09Å
262	F	28.6	Very low	39.9	Very low	174 Å²	174	129.3 Å²	129.3	76%	0.763	75%	0.75	S	S	*	*			trans	-62.6	101.7	176.8	-175.7	-92.9	0	0	0	111.5	S260	S260-F262 PolarHBondContact O-N 3.47Å
263	V	39.7	Very low	42	Very low	129 Å²	129	129.3 Å²	129.3	78%	0.782	74%	0.741	S	S	*	*			trans	-80.1	123.2	172.4	179.1	0	0	0	0	109.2	S261 P265	S261-V263 PolarHBondContact O-N 3.09Å; V263-P265 WeakPolarHBondContact O-CD 3.47Å
264	S	28.5	Very low	44.1	Very low	85 Å²	85	125.8 Å²	125.8	59%	0.594	72%	0.72	S	S	*	*			trans	-62.7	121.3	179.3	-52.5	0	0	0	0	112.1	S266	S264-S266 PolarHBondContact O-N 2.89Å
265	P	40.2	Very low	46.4	Very low	120 Å²	120	123.2 Å²	123.2	78%	0.779	70%	0.703	S	S	*	*			trans	-84.5	90.7	179.6	32.6	-33	0	0	0	111	V263	V263-P265 WeakPolarHBondContact O-CD 3.47Å
266	S	42.6	Very low	49	Very low	104 Å²	104	127 Å²	127	73%	0.727	70%	0.698	S	S	*	*			trans	-149	49.8	-179.1	68.7	0	0	0	0	114.7	S264	S264-S266 PolarHBondContact O-N 2.89Å
267	C	39.7	Very low	51.8	Low	127 Å²	127	122.9 Å²	122.9	86%	0.858	68%	0.675	S	S	*	*	S	Bend	trans	-157.5	17.9	171.9	64.4	0	0	0	0	116.2
268	L	47	Very low	54	Low	145 Å²	145	123.6 Å²	123.6	76%	0.759	67%	0.668	S	S	*	*			trans	-106.3	-6.3	-171.6	-119.9	171	0	0	0	115.8
269	D	44.9	Very low	56.9	Low	161 Å²	161	119.1 Å²	119.1	86%	0.861	65%	0.647	S	S	*	*			trans	-106.4	84	173.7	-70.1	-80.1	0	0	0	110.5	P271	D269-P271 WeakPolarHBondContact O-CD 3.44Å
270	D	57.3	Low	59.6	Low	84 Å²	84	117.2 Å²	117.2	45%	0.449	64%	0.636	S	S	.	*			trans	-93.4	103.7	162.4	176.5	12.4	0	0	0	108.2	D272 R273	D270-D272 PolarHBondContact O-N 3.36Å; D270-D272 WeakPolarHBondContact OD1-CB 3.33Å; D270-D272 PolarHBondContact OD1-N 2.93Å; D270-R273 HydrophobicContact CB-CB 4.06Å; D270-R273 WeakPolarHBondContact O-CB 3.45Å; D270-R273 PolarHBondContact O-N 3.33Å
271	P	63	Low	62.2	Low	104 Å²	104	117.3 Å²	117.3	68%	0.675	63%	0.625	S	S	*	*	H	α-helix	trans	-64.4	-26.4	-173.5	26.6	-34.7	0	0	0	112.8	D269 R273 Q275	D269-P271 WeakPolarHBondContact O-CD 3.44Å; P271-R273 VanDerWaalsContact C-N 3.31Å; P271-R273 PolarHBondContact O-N 3.49Å; P271-Q275 PolarHBondContact O-N 3.32Å
272	D	73.7	Confident	65	Low	80 Å²	80	117.7 Å²	117.7	43%	0.428	62%	0.617	S	S	.	*	H	α-helix	trans	-68.4	-30.5	175.5	-100.7	44.9	0	0	0	111.9	D270 Q275 R276	D270-D272 PolarHBondContact O-N 3.36Å; D270-D272 WeakPolarHBondContact OD1-CB 3.33Å; D270-D272 PolarHBondContact OD1-N 2.93Å; D272-Q275 PolarHBondContact O-N 3.38Å; D272-R276 WeakPolarHBondContact O-CB 3.23Å; D272-R276 VanDerWaalsContact O-CG 3.23Å; D272-R276 WeakPolarHBondContact O-CG 3.34Å; D272-R276 PolarHBondContact O-N 2.78Å; D272-R276 IonicContact OD2-CZ 3.75Å; D272-R276 IonicContact OD2-NE 3.51Å; D272-R276 IonicContact OD2-NH2 3.59Å; D272-R276 PolarHBondContact OD2-NH2 2.91Å
273	R	77.8	Confident	68.1	Low	148 Å²	148	114.6 Å²	114.6	56%	0.558	61%	0.608	S	S	*	*	H	α-helix	trans	-64.8	-46.1	-178	-174.6	-178.5	-179.7	-167.6	-1.7	111.3	D270 P271 Q275 R276 I277	D270-R273 HydrophobicContact CB-CB 4.06Å; D270-R273 WeakPolarHBondContact O-CB 3.45Å; D270-R273 PolarHBondContact O-N 3.33Å; P271-R273 VanDerWaalsContact C-N 3.31Å; P271-R273 PolarHBondContact O-N 3.49Å; R273-Q275 VanDerWaalsContact C-N 3.31Å; R273-Q275 PolarHBondContact O-N 2.97Å; R273-R276 PolarHBondContact O-N 3.26Å; R273-I277 HydrophobicContact CG-CD1 4.23Å; R273-I277 WeakPolarHBondContact O-CG1 3.46Å; R273-I277 PolarHBondContact O-N 3.43Å
274	E	80.5	Confident	70.3	Confident	104 Å²	104	113.2 Å²	113.2	49%	0.486	60%	0.596	S	S	.	*	H	α-helix	trans	-68.8	-32.8	-178.8	-158.9	69.9	-178.8	0	0	111.6	K278	E274-K278 WeakPolarHBondContact O-CD 3.3Å; E274-K278 WeakPolarHBondContact O-CG 3.38Å; E274-K278 PolarHBondContact O-N 3.33Å; E274-K278 IonicContact OE1-NZ 3.79Å
275	Q	82.4	Confident	72.7	Confident	112 Å²	112	114.2 Å²	114.2	52%	0.523	59%	0.592	S	S	.	*	H	α-helix	trans	-68.8	-44.9	171.7	-178.2	169	-31.7	0	0	111.7	P271 D272 R273 I277 K278 E279	P271-Q275 PolarHBondContact O-N 3.32Å; D272-Q275 PolarHBondContact O-N 3.38Å; R273-Q275 VanDerWaalsContact C-N 3.31Å; R273-Q275 PolarHBondContact O-N 2.97Å; Q275-I277 VanDerWaalsContact C-N 3.28Å; Q275-I277 PolarHBondContact O-N 3.15Å; Q275-K278 PolarHBondContact O-N 2.7Å; Q275-K278 VanDerWaalsContact O-N 3.13Å; Q275-E279 HydrophobicContact CG-CG 4.32Å; Q275-E279 WeakPolarHBondContact CG-OE1 3.1Å; Q275-E279 PolarHBondContact NE2-OE1 3.13Å; Q275-E279 WeakPolarHBondContact O-CG 3.34Å; Q275-E279 PolarHBondContact O-N 3.18Å
276	R	85.3	Confident	74.8	Confident	144 Å²	144	111.4 Å²	111.4	54%	0.543	58%	0.575	S	S	.	*	H	α-helix	trans	-63.3	-32.5	177.4	-70.7	170.3	-159.3	169	9.3	112.8	D272 R273 L280	D272-R276 WeakPolarHBondContact O-CB 3.23Å; D272-R276 VanDerWaalsContact O-CG 3.23Å; D272-R276 WeakPolarHBondContact O-CG 3.34Å; D272-R276 PolarHBondContact O-N 2.78Å; D272-R276 IonicContact OD2-CZ 3.75Å; D272-R276 IonicContact OD2-NE 3.51Å; D272-R276 IonicContact OD2-NH2 3.59Å; D272-R276 PolarHBondContact OD2-NH2 2.91Å; R273-R276 PolarHBondContact O-N 3.26Å; R276-L280 WeakPolarHBondContact O-CB 3.34Å; R276-L280 PolarHBondContact O-N 3.1Å
277	I	88.8	Confident	76.8	Confident	81 Å²	81	108.7 Å²	108.7	42%	0.415	56%	0.56	S	S	.	*	H	α-helix	trans	-63.2	-48.5	172	-70.5	164.8	0	0	0	110.1	R273 Q275 L280 E281	R273-I277 HydrophobicContact CG-CD1 4.23Å; R273-I277 WeakPolarHBondContact O-CG1 3.46Å; R273-I277 PolarHBondContact O-N 3.43Å; Q275-I277 VanDerWaalsContact C-N 3.28Å; Q275-I277 PolarHBondContact O-N 3.15Å; I277-L280 PolarHBondContact O-N 2.87Å; I277-E281 WeakPolarHBondContact O-CB 3.44Å; I277-E281 PolarHBondContact O-N 2.75Å
278	K	86.9	Confident	78.8	Confident	115 Å²	115	108.3 Å²	108.3	50%	0.5	55%	0.545	S	S	.	.	H	α-helix	trans	-67.5	-35	179.5	-71.7	162.7	-174.7	159.7	0	113.2	E274 Q275 L282	E274-K278 WeakPolarHBondContact O-CD 3.3Å; E274-K278 WeakPolarHBondContact O-CG 3.38Å; E274-K278 PolarHBondContact O-N 3.33Å; E274-K278 IonicContact OE1-NZ 3.79Å; Q275-K278 PolarHBondContact O-N 2.7Å; Q275-K278 VanDerWaalsContact O-N 3.13Å; K278-L282 WeakPolarHBondContact O-CB 3.43Å; K278-L282 PolarHBondContact O-N 2.94Å
279	E	91.6	Very high	80.3	Confident	103 Å²	103	104.6 Å²	104.6	48%	0.481	53%	0.531	S	S	.	.	H	α-helix	trans	-65.5	-39.3	171.7	-74.5	174.8	-174	0	0	111.5	Q275 L283	Q275-E279 HydrophobicContact CG-CG 4.32Å; Q275-E279 WeakPolarHBondContact CG-OE1 3.1Å; Q275-E279 PolarHBondContact NE2-OE1 3.13Å; Q275-E279 WeakPolarHBondContact O-CG 3.34Å; Q275-E279 PolarHBondContact O-N 3.18Å; E279-L283 VanDerWaalsContact O-CB 3.23Å; E279-L283 WeakPolarHBondContact O-CB 3.37Å; E279-L283 PolarHBondContact O-N 2.66Å
280	L	89.8	Confident	82.1	Confident	117 Å²	117	101.1 Å²	101.1	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-70.9	-41.1	177.3	-160.8	75.6	0	0	0	112.3	R276 I277 L283 L284	R276-L280 WeakPolarHBondContact O-CB 3.34Å; R276-L280 PolarHBondContact O-N 3.1Å; I277-L280 PolarHBondContact O-N 2.87Å; L280-L283 PolarHBondContact O-N 2.71Å; L280-L284 PolarHBondContact O-N 3.48Å
281	E	87.2	Confident	82.9	Confident	116 Å²	116	101.4 Å²	101.4	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-49.4	175	-178.1	176.7	-153.5	0	0	111.3	I277 L283 L284 M285	I277-E281 WeakPolarHBondContact O-CB 3.44Å; I277-E281 PolarHBondContact O-N 2.75Å; E281-L283 VanDerWaalsContact C-N 3.3Å; E281-L283 PolarHBondContact O-N 3.01Å; E281-L284 WeakPolarHBondContact O-CB 3.46Å; E281-L284 PolarHBondContact O-N 3.43Å; E281-M285 HydrophobicContact CG-SD 4.46Å; E281-M285 WeakPolarHBondContact O-CG 3.43Å; E281-M285 PolarHBondContact O-N 3.28Å
282	L	90.5	Very high	83.2	Confident	119 Å²	119	102.2 Å²	102.2	62%	0.623	51%	0.509	S	S	*	.	H	α-helix	trans	-61.4	-37.8	175.2	-178.3	63.1	0	0	0	112.1	K278 S286	K278-L282 WeakPolarHBondContact O-CB 3.43Å; K278-L282 PolarHBondContact O-N 2.94Å; L282-S286 WeakPolarHBondContact O-CB 3.38Å; L282-S286 PolarHBondContact O-N 3.35Å
283	L	91.8	Very high	83	Confident	109 Å²	109	104.2 Å²	104.2	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-68.1	-39.7	176.7	-165.9	151.5	0	0	0	111.2	E279 L280 E281 S286 A287	E279-L283 VanDerWaalsContact O-CB 3.23Å; E279-L283 WeakPolarHBondContact O-CB 3.37Å; E279-L283 PolarHBondContact O-N 2.66Å; L280-L283 PolarHBondContact O-N 2.71Å; E281-L283 VanDerWaalsContact C-N 3.3Å; E281-L283 PolarHBondContact O-N 3.01Å; L283-S286 WeakPolarHBondContact CA-OG 3.35Å; L283-S286 PolarHBondContact O-N 3.03Å; L283-S286 PolarHBondContact O-OG 3.3Å; L283-A287 PolarHBondContact O-N 2.91Å
284	L	87.1	Confident	82.2	Confident	100 Å²	100	103.4 Å²	103.4	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-59.7	-53.4	173.2	-136.1	78.2	0	0	0	111.2	L280 E281 S286 A287 E288	L280-L284 PolarHBondContact O-N 3.48Å; E281-L284 WeakPolarHBondContact O-CB 3.46Å; E281-L284 PolarHBondContact O-N 3.43Å; L284-S286 PolarHBondContact O-N 3.33Å; L284-A287 PolarHBondContact O-N 3.4Å; L284-E288 WeakPolarHBondContact O-CG 3.47Å; L284-E288 PolarHBondContact O-N 2.87Å
285	M	78.3	Confident	81.2	Confident	105 Å²	105	102.9 Å²	102.9	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-57	-36.2	176.9	-68.2	173.5	67.2	0	0	112.2	E281 S289	E281-M285 HydrophobicContact CG-SD 4.46Å; E281-M285 WeakPolarHBondContact O-CG 3.43Å; E281-M285 PolarHBondContact O-N 3.28Å; M285-S289 VanDerWaalsContact O-CB 3.28Å; M285-S289 WeakPolarHBondContact O-CB 3.4Å; M285-S289 PolarHBondContact O-N 3.44Å; M285-S289 PolarHBondContact O-OG 3.3Å
286	S	84.3	Confident	79.8	Confident	61 Å²	61	104.4 Å²	104.4	43%	0.427	52%	0.524	S	S	.	.	H	α-helix	trans	-69.2	-38.5	176.8	79.2	0	0	0	0	112.7	L282 L283 L284 S289 E290	L282-S286 WeakPolarHBondContact O-CB 3.38Å; L282-S286 PolarHBondContact O-N 3.35Å; L283-S286 WeakPolarHBondContact CA-OG 3.35Å; L283-S286 PolarHBondContact O-N 3.03Å; L283-S286 PolarHBondContact O-OG 3.3Å; L284-S286 PolarHBondContact O-N 3.33Å; S286-S289 PolarHBondContact O-N 2.61Å; S286-E290 PolarHBondContact O-N 2.83Å
287	A	84.1	Confident	78	Confident	48 Å²	48	102.8 Å²	102.8	40%	0.397	53%	0.534	S	S	.	.	H	α-helix	trans	-71.9	-40.7	177.8	0	0	0	0	0	111.9	L283 L284 S289 E290 V291	L283-A287 PolarHBondContact O-N 2.91Å; L284-A287 PolarHBondContact O-N 3.4Å; A287-S289 VanDerWaalsContact C-N 3.32Å; A287-S289 PolarHBondContact O-N 3.23Å; A287-E290 WeakPolarHBondContact O-CB 3.4Å; A287-E290 PolarHBondContact O-N 2.99Å; A287-E290 VanDerWaalsContact O-N 3.14Å; A287-V291 WeakPolarHBondContact O-CG2 3.32Å; A287-V291 PolarHBondContact O-N 2.89Å
288	E	81.6	Confident	75.9	Confident	118 Å²	118	110 Å²	110	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-60.8	-42.7	171.8	-70.4	168.9	-176.9	0	0	110.7	L284 E290 V291 Q292	L284-E288 WeakPolarHBondContact O-CG 3.47Å; L284-E288 PolarHBondContact O-N 2.87Å; E288-E290 VanDerWaalsContact C-N 3.31Å; E288-E290 PolarHBondContact O-N 3.24Å; E288-V291 PolarHBondContact O-N 3.33Å; E288-Q292 WeakPolarHBondContact O-CB 3.39Å; E288-Q292 PolarHBondContact O-N 2.74Å
289	S	79.2	Confident	73.7	Confident	67 Å²	67	107.5 Å²	107.5	47%	0.469	56%	0.562	S	S	.	*	H	α-helix	trans	-65.7	-28.1	173.6	-59.9	0	0	0	0	113.8	M285 S286 A287 R293	M285-S289 VanDerWaalsContact O-CB 3.28Å; M285-S289 WeakPolarHBondContact O-CB 3.4Å; M285-S289 PolarHBondContact O-N 3.44Å; M285-S289 PolarHBondContact O-OG 3.3Å; S286-S289 PolarHBondContact O-N 2.61Å; A287-S289 VanDerWaalsContact C-N 3.32Å; A287-S289 PolarHBondContact O-N 3.23Å; S289-R293 VanDerWaalsContact O-CG 3.32Å; S289-R293 WeakPolarHBondContact O-CG 3.46Å; S289-R293 PolarHBondContact O-N 2.7Å; S289-R293 PolarHBondContact O-NE 2.83Å
290	E	83.3	Confident	71.5	Confident	88 Å²	88	107.8 Å²	107.8	41%	0.411	58%	0.575	S	S	.	*	H	α-helix	trans	-70.1	-49.1	172.9	-161.8	76.6	-115.5	0	0	110.7	S286 A287 E288 Q292 R293 H294	S286-E290 PolarHBondContact O-N 2.83Å; A287-E290 WeakPolarHBondContact O-CB 3.4Å; A287-E290 PolarHBondContact O-N 2.99Å; A287-E290 VanDerWaalsContact O-N 3.14Å; E288-E290 VanDerWaalsContact C-N 3.31Å; E288-E290 PolarHBondContact O-N 3.24Å; E290-Q292 PolarHBondContact O-N 3.03Å; E290-R293 PolarHBondContact O-N 3Å; E290-R293 IonicContact OE1-CZ 2.99Å; E290-R293 VanDerWaalsContact OE1-CZ 3.23Å; E290-R293 IonicContact OE1-NH1 3.23Å; E290-R293 PolarHBondContact OE1-NH1 3.12Å; E290-R293 IonicContact OE1-NH2 2.71Å; E290-R293 PolarHBondContact OE1-NH2 3.38Å; E290-R293 IonicContact OE2-CZ 2.84Å; E290-R293 IonicContact OE2-NH1 3.84Å; E290-R293 IonicContact OE2-NH2 2.67Å; E290-R293 PolarHBondContact OE2-NH2 3.29Å; E290-H294 PolarHBondContact O-CD2 3.36Å; E290-H294 VanDerWaalsContact O-CD2 3.29Å; E290-H294 PolarHBondContact O-N 3.42Å
291	V	74.3	Confident	68.7	Low	91 Å²	91	114.3 Å²	114.3	55%	0.552	59%	0.592	S	S	*	*	H	α-helix	trans	-61.1	-45.8	177.4	173.5	0	0	0	0	110.9	A287 E288 R293 H294 V295	A287-V291 WeakPolarHBondContact O-CG2 3.32Å; A287-V291 PolarHBondContact O-N 2.89Å; E288-V291 PolarHBondContact O-N 3.33Å; V291-R293 VanDerWaalsContact C-N 3.33Å; V291-R293 PolarHBondContact O-N 2.98Å; V291-H294 WeakPolarHBondContact O-CB 3.21Å; V291-H294 PolarHBondContact O-N 2.9Å; V291-H294 VanDerWaalsContact O-N 3.09Å; V291-V295 PolarHBondContact O-N 3.09Å
292	Q	68.6	Low	66.1	Low	120 Å²	120	114.4 Å²	114.4	56%	0.561	61%	0.606	S	S	*	*	H	α-helix	trans	-61.8	-40	179.4	-158.3	70.2	0.9	0	0	112.1	E288 E290 V295 Q296	E288-Q292 WeakPolarHBondContact O-CB 3.39Å; E288-Q292 PolarHBondContact O-N 2.74Å; E290-Q292 PolarHBondContact O-N 3.03Å; Q292-V295 PolarHBondContact O-N 3.04Å; Q292-Q296 PolarHBondContact O-N 3.16Å
293	R	70.3	Confident	63.4	Low	123 Å²	123	114.7 Å²	114.7	46%	0.464	61%	0.612	S	S	.	*	H	α-helix	trans	-64.1	-40.6	172.7	-77.4	-178.7	-71	108.6	-9.9	112.4	S289 E290 V291 V295 Q296 C297	S289-R293 VanDerWaalsContact O-CG 3.32Å; S289-R293 WeakPolarHBondContact O-CG 3.46Å; S289-R293 PolarHBondContact O-N 2.7Å; S289-R293 PolarHBondContact O-NE 2.83Å; E290-R293 PolarHBondContact O-N 3Å; E290-R293 IonicContact OE1-CZ 2.99Å; E290-R293 VanDerWaalsContact OE1-CZ 3.23Å; E290-R293 IonicContact OE1-NH1 3.23Å; E290-R293 PolarHBondContact OE1-NH1 3.12Å; E290-R293 IonicContact OE1-NH2 2.71Å; E290-R293 PolarHBondContact OE1-NH2 3.38Å; E290-R293 IonicContact OE2-CZ 2.84Å; E290-R293 IonicContact OE2-NH1 3.84Å; E290-R293 IonicContact OE2-NH2 2.67Å; E290-R293 PolarHBondContact OE2-NH2 3.29Å; V291-R293 VanDerWaalsContact C-N 3.33Å; V291-R293 PolarHBondContact O-N 2.98Å; R293-V295 VanDerWaalsContact C-N 3.3Å; R293-V295 PolarHBondContact O-N 3.31Å; R293-Q296 PolarHBondContact O-N 2.84Å; R293-C297 WeakPolarHBondContact O-CB 3.36Å; R293-C297 PolarHBondContact O-N 3.23Å; R293-C297 PolarHBondContact O-SG 2.73Å; R293-C297 VanDerWaalsContact O-SG 3.39Å
294	H	60.2	Low	60.4	Low	131 Å²	131	118.8 Å²	118.8	61%	0.606	63%	0.628	S	S	*	*	H	α-helix	trans	-64.8	-32.1	176.6	-88.3	-118	0	0	0	113.2	E290 V291	E290-H294 PolarHBondContact O-CD2 3.36Å; E290-H294 VanDerWaalsContact O-CD2 3.29Å; E290-H294 PolarHBondContact O-N 3.42Å; V291-H294 WeakPolarHBondContact O-CB 3.21Å; V291-H294 PolarHBondContact O-N 2.9Å; V291-H294 VanDerWaalsContact O-N 3.09Å
295	V	60.8	Low	57.8	Low	93 Å²	93	120.9 Å²	120.9	56%	0.564	64%	0.635	S	S	*	*	H	α-helix	trans	-69.5	-52	170.7	174.5	0	0	0	0	110.4	V291 Q292 R293 C297 R298	V291-V295 PolarHBondContact O-N 3.09Å; Q292-V295 PolarHBondContact O-N 3.04Å; R293-V295 VanDerWaalsContact C-N 3.3Å; R293-V295 PolarHBondContact O-N 3.31Å; V295-C297 VanDerWaalsContact C-N 3.33Å; V295-C297 PolarHBondContact O-N 3.1Å; V295-R298 PolarHBondContact O-N 3.11Å
296	Q	52.9	Low	55.3	Low	143 Å²	143	125.2 Å²	125.2	67%	0.668	65%	0.647	S	S	*	*	H	α-helix	trans	-59.8	-40.1	-176.4	-148.8	74.7	22.4	0	0	112.8	Q292 R293 R298 G299	Q292-Q296 PolarHBondContact O-N 3.16Å; R293-Q296 PolarHBondContact O-N 2.84Å; Q296-R298 VanDerWaalsContact C-N 3.27Å; Q296-R298 PolarHBondContact O-N 3.45Å; Q296-G299 PolarHBondContact O-N 2.87Å
297	C	46.1	Very low	53.2	Low	111 Å²	111	127.9 Å²	127.9	75%	0.75	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-8.3	-177.2	-71.2	0	0	0	0	115.1	R293 V295 G299	R293-C297 WeakPolarHBondContact O-CB 3.36Å; R293-C297 PolarHBondContact O-N 3.23Å; R293-C297 PolarHBondContact O-SG 2.73Å; R293-C297 VanDerWaalsContact O-SG 3.39Å; V295-C297 VanDerWaalsContact C-N 3.33Å; V295-C297 PolarHBondContact O-N 3.1Å; C297-G299 VanDerWaalsContact C-N 3.33Å
298	R	45.4	Very low	50.8	Low	232 Å²	232	130 Å²	130	88%	0.875	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-17.7	169	-94.8	-175.2	175.7	-112.4	0.8	113.2	V295 Q296 S300	V295-R298 PolarHBondContact O-N 3.11Å; Q296-R298 VanDerWaalsContact C-N 3.27Å; Q296-R298 PolarHBondContact O-N 3.45Å; R298-S300 PolarHBondContact O-N 3.46Å
299	G	41.1	Very low	48.3	Very low	62 Å²	62	136.3 Å²	136.3	64%	0.639	70%	0.7	S	S	*	*	S	Bend	trans	-86	24.2	-169.1	0	0	0	0	0	117.5	Q296 C297	Q296-G299 PolarHBondContact O-N 2.87Å; C297-G299 VanDerWaalsContact C-N 3.33Å
300	S	43.9	Very low	46	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	71%	0.714	S	S	*	*			trans	-171.1	103.7	169.3	-88.6	0	0	0	0	115	R298	R298-S300 PolarHBondContact O-N 3.46Å
301	R	32.1	Very low	43.4	Very low	255 Å²	255	141.4 Å²	141.4	96%	0.962	73%	0.733	S	S	*	*			trans	-164.3	147.3	139.5	-111.8	170.3	-168.7	-148.5	-0.9	111.7
302	S	32.3	Very low	41.3	Very low	118 Å²	118	143 Å²	143	83%	0.825	75%	0.748	S	S	*	*			trans	-85	155.1	-169.1	-173.4	0	0	0	0	114.2
303	V	34.3	Very low	39.8	Very low	125 Å²	125	145 Å²	145	76%	0.758	76%	0.762	S	S	*	*			trans	-48.4	139.7	167.6	176.4	0	0	0	0	113.5
304	E	28.5	Very low	38.1	Very low	195 Å²	195	145.1 Å²	145.1	91%	0.911	78%	0.782	S	S	*	*			trans	-144.7	170.6	140.8	-152.5	159.9	-145.9	0	0	108.8
305	Q	31.8	Very low	36.9	Very low	143 Å²	143	147.9 Å²	147.9	67%	0.668	80%	0.795	S	S	*	*			trans	-131.9	167.2	-133.7	-162.4	175	18.5	0	0	116.8
306	Y	26.8	Very low	35.4	Very low	197 Å²	197	151.4 Å²	151.4	77%	0.773	81%	0.81	S	S	*	*			trans	89	152.6	164.8	-65.8	-83	0	0	0	119.5
307	P	40.3	Very low	34.4	Very low	117 Å²	117	148.8 Å²	148.8	76%	0.76	81%	0.808	S	S	*	*			cis	-123.6	169.1	-22.8	32.4	-15.2	0	0	0	113.7
308	A	33.2	Very low	33.7	Very low	93 Å²	93	151 Å²	151	77%	0.769	81%	0.81	S	S	*	*			trans	-139.1	148.5	171.4	0	0	0	0	0	111.7
309	W	30.2	Very low	32.9	Very low	249 Å²	249	145.4 Å²	145.4	94%	0.943	80%	0.801	S	S	*	*			trans	-140.9	150.6	166.9	-67.3	-19.8	0	0	0	107.7
310	S	30.1	Very low	32.3	Very low	111 Å²	111	148.5 Å²	148.5	78%	0.776	81%	0.808	S	S	*	*			cis	-167.5	154.3	-23.8	-95.7	0	0	0	0	107.9
311	D	29.1	Very low	31.5	Very low	151 Å²	151	147.8 Å²	147.8	81%	0.807	80%	0.803	S	S	*	*			trans	-65.8	155.4	178.7	-69.5	-72	0	0	0	114.8
312	S	28.6	Very low	31.2	Very low	124 Å²	124	140.6 Å²	140.6	87%	0.867	79%	0.792	S	S	*	*				-161.4	131	127.2	-80.4	0	0	0	0	111.9
313	L	37.9	Very low	30.8	Very low	164 Å²	164	140.4 Å²	140.4	86%	0.859	79%	0.79	S	S	*	*			trans	-102.3	148.6	166.2	-71.3	169.4	0	0	0	110
314	S	35	Very low	30.5	Very low	125 Å²	125	140.7 Å²	140.7	87%	0.874	79%	0.787	S	S	*	*			trans	-165.1	147.8	143.3	-78.1	0	0	0	0	110.1
315	E	34.2	Very low	30.8	Very low	188 Å²	188	138.9 Å²	138.9	88%	0.879	78%	0.778	S	S	*	*			trans	-79.5	162.2	171.2	-65.1	150.1	88.9	0	0	110.9
316	D	30.3	Very low	30.9	Very low	167 Å²	167	138.7 Å²	138.7	89%	0.893	78%	0.777	S	S	*	*				-167.4	-175.9	105.4	-137.1	-39.7	0	0	0	112
317	S	30.6	Very low	31.1	Very low	89 Å²	89	137.1 Å²	137.1	62%	0.622	78%	0.777	S	S	*	*			trans	-130.9	173	-156.8	-156.9	0	0	0	0	116.1
318	M	31.4	Very low	30.6	Very low	158 Å²	158	135.2 Å²	135.2	78%	0.778	77%	0.771	S	S	*	*			trans	73.9	104.1	159.5	-59.2	-71.6	173.6	0	0	121.8
319	T	28.4	Very low	30.5	Very low	113 Å²	113	137.9 Å²	137.9	69%	0.693	77%	0.768	S	S	*	*				66.2	128	126.5	-32.3	0	0	0	0	122.5
320	T	28.7	Very low	30.5	Very low	127 Å²	127	136.5 Å²	136.5	78%	0.779	76%	0.763	S	S	*	*				150.5	137.9	125.4	48.8	0	0	0	0	116.9
321	S	27.9	Very low	30.3	Very low	95 Å²	95	134.5 Å²	134.5	66%	0.664	76%	0.759	S	S	*	*			trans	45.5	111.9	143.4	64.5	0	0	0	0	125.3
322	S	25	Very low	31.2	Very low	104 Å²	104	132.6 Å²	132.6	73%	0.727	76%	0.755	S	S	*	*				51.5	154.8	120.6	68.7	0	0	0	0	125.1
323	S	25.5	Very low	31.2	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	76%	0.756	S	S	*	*			trans	76.3	157.3	160.8	-72.2	0	0	0	0	118
324	L	28.1	Very low	31	Very low	130 Å²	130	140.5 Å²	140.5	68%	0.681	76%	0.755	S	S	*	*			cis	-176.1	129.5	-23.6	173.9	72.9	0	0	0	108
325	E	33.9	Very low	30.8	Very low	158 Å²	158	137.7 Å²	137.7	74%	0.738	75%	0.746	S	S	*	*			trans	58.5	173.1	161.5	-72.1	170.2	149.1	0	0	116.6
326	E	33.8	Very low	31.3	Very low	138 Å²	138	134.8 Å²	134.8	65%	0.645	74%	0.743	S	S	*	*			cis	-153.2	167.5	-8.3	-130.8	-174.1	148.1	0	0	111.1
327	Q	31.1	Very low	31.5	Very low	165 Å²	165	133.8 Å²	133.8	77%	0.771	74%	0.738	S	S	*	*			trans	28.1	158.8	142.5	-73.2	-173.8	42.2	0	0	124.1
328	A	29.7	Very low	31.7	Very low	77 Å²	77	137.2 Å²	137.2	64%	0.636	75%	0.747	S	S	*	*			cis	-172.4	170	-14	0	0	0	0	0	112.9
329	E	31.5	Very low	32	Very low	149 Å²	149	135.6 Å²	135.6	70%	0.696	75%	0.749	S	S	*	*			trans	41.6	125.9	155.7	-67.2	-169.9	-177.5	0	0	123.7
330	R	30.8	Very low	32.5	Very low	220 Å²	220	134.6 Å²	134.6	83%	0.83	75%	0.752	S	S	*	*				166	156.2	102.2	-82.3	-163.4	-158.7	-51.2	-21.5	113
331	G	25.6	Very low	33	Very low	68 Å²	68	134.1 Å²	134.1	70%	0.701	75%	0.751	S	S	*	*			trans	-121.2	-152.4	163.5	0	0	0	0	0	110.8
332	P	47	Very low	34	Very low	112 Å²	112	135.2 Å²	135.2	73%	0.727	76%	0.756	S	S	*	*			cis	-147.3	166.3	-1.6	42.1	-22.6	0	0	0	118.8
333	W	29.2	Very low	34.7	Very low	231 Å²	231	135.7 Å²	135.7	88%	0.875	76%	0.757	S	S	*	*			trans	54	137	154	-62.6	121.3	0	0	0	122.1
334	R	34.1	Very low	35.3	Very low	222 Å²	222	139.4 Å²	139.4	84%	0.838	76%	0.761	S	S	*	*			cis	-136	-169	24.9	-66.4	177	-62.6	-70.9	-3.3	111.5
335	G	30.6	Very low	35.8	Very low	67 Å²	67	139 Å²	139	69%	0.691	76%	0.764	S	S	*	*			cis	95.9	140.4	15.8	0	0	0	0	0	112.9
336	P	44.7	Very low	36.1	Very low	126 Å²	126	135.8 Å²	135.8	82%	0.818	76%	0.759	S	S	*	*			cis	-123.7	-169.3	38.8	44.3	-32.6	0	0	0	116.8
337	D	32.9	Very low	36.5	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	76%	0.764	S	S	*	*			trans	-66.7	165.4	-169.2	-45.4	-90.8	0	0	0	115.3
338	I	35.9	Very low	37.1	Very low	160 Å²	160	131.8 Å²	131.8	82%	0.821	76%	0.762	S	S	*	*			cis	-145.2	-167.5	33.6	-26.7	176.2	0	0	0	111.7
339	P	38.6	Very low	38	Very low	124 Å²	124	136.4 Å²	136.4	81%	0.805	77%	0.768	S	S	*	*				-87.9	158.9	-109.8	40.2	-30	0	0	0	116.7
340	A	37.1	Very low	38.5	Very low	92 Å²	92	138 Å²	138	76%	0.76	77%	0.772	S	S	*	*			trans	-129.4	154.9	170.5	0	0	0	0	0	111.1
341	P	40.1	Very low	39.4	Very low	118 Å²	118	133.7 Å²	133.7	77%	0.766	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-73.8	156.7	-172.8	30	-36.3	0	0	0	113.8
342	P	48.5	Very low	40.3	Very low	118 Å²	118	135.2 Å²	135.2	77%	0.766	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-69.8	139.3	179.7	29	-35.1	0	0	0	112.2
343	P	41	Very low	40.4	Very low	114 Å²	114	133.1 Å²	133.1	74%	0.74	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-70.8	143.1	174.7	29.5	-34.3	0	0	0	111.8	V345	P343-V345 PolarHBondContact O-N 3.47Å
344	Q	37.6	Very low	41.4	Very low	191 Å²	191	128.5 Å²	128.5	89%	0.893	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-66	119.2	176.7	-70	-85.1	-30.9	0	0	110.7
345	V	37.7	Very low	42.2	Very low	121 Å²	121	120.5 Å²	120.5	73%	0.733	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-98.2	123.5	173.7	-179.1	0	0	0	0	109.4	P343	P343-V345 PolarHBondContact O-N 3.47Å
346	S	40.3	Very low	43.4	Very low	91 Å²	91	120.5 Å²	120.5	64%	0.636	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-64.4	146.8	-174.9	-49	0	0	0	0	113.1	S348	S346-S348 VanDerWaalsContact C-N 3.27Å; S346-S348 PolarHBondContact O-N 3.03Å
347	P	43	Very low	44.1	Very low	115 Å²	115	117.3 Å²	117.3	75%	0.747	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-65.9	-17.2	-163.4	-24.9	35.9	0	0	0	116.9	K349 F350	P347-K349 PolarHBondContact O-N 2.87Å; P347-F350 PolarHBondContact O-N 3.37Å
348	S	43.7	Very low	45.2	Very low	104 Å²	104	114 Å²	114	73%	0.727	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-72.6	8.8	-164.3	-45.1	0	0	0	0	116.6	S346	S346-S348 VanDerWaalsContact C-N 3.27Å; S346-S348 PolarHBondContact O-N 3.03Å
349	K	47.3	Very low	46.2	Very low	175 Å²	175	111.5 Å²	111.5	76%	0.761	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-111.4	-9.5	179.6	-68.9	-169.8	177.4	-176.4	0	115.3	P347	P347-K349 PolarHBondContact O-N 2.87Å
350	F	42.6	Very low	47.2	Very low	182 Å²	182	109.2 Å²	109.2	80%	0.798	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-41	-178.6	-115	-96.9	0	0	0	113.5	P347 T352 A353	P347-F350 PolarHBondContact O-N 3.37Å; F350-T352 VanDerWaalsContact C-N 3.32Å; F350-T352 PolarHBondContact O-N 3.3Å; F350-A353 PolarHBondContact O-N 2.87Å
351	L	49.2	Very low	48.4	Very low	130 Å²	130	109.2 Å²	109.2	68%	0.681	65%	0.646	S	S	*	*	H	α-helix	trans	-64.1	-30.9	-173.4	-66.7	171.7	0	0	0	114.1	A355	L351-A355 PolarHBondContact O-N 3.48Å
352	T	45.6	Very low	49	Very low	100 Å²	100	106.6 Å²	106.6	61%	0.613	63%	0.625	S	S	*	*	H	α-helix	trans	-71.2	-33.5	-178.4	-40.8	0	0	0	0	112.7	F350 S356	F350-T352 VanDerWaalsContact C-N 3.32Å; F350-T352 PolarHBondContact O-N 3.3Å; T352-S356 PolarHBondContact O-N 3.2Å; T352-S356 PolarHBondContact O-OG 2.89Å
353	A	48.3	Very low	49.5	Very low	67 Å²	67	107.2 Å²	107.2	55%	0.554	62%	0.618	S	S	*	*	H	α-helix	trans	-72.6	-43.6	-179.9	0	0	0	0	0	111.5	F350 S356 A357	F350-A353 PolarHBondContact O-N 2.87Å; A353-S356 PolarHBondContact O-N 2.91Å; A353-A357 PolarHBondContact O-N 3.39Å
354	E	50.8	Low	50.4	Low	135 Å²	135	107.1 Å²	107.1	63%	0.631	62%	0.616	S	S	*	*	H	α-helix	trans	-65.1	-41.8	179.2	-169	170.9	-142.2	0	0	111.9	S356 A357 V358	E354-S356 VanDerWaalsContact C-N 3.27Å; E354-S356 PolarHBondContact O-N 3.5Å; E354-A357 PolarHBondContact O-N 3.23Å; E354-V358 WeakPolarHBondContact O-CG2 3.36Å; E354-V358 PolarHBondContact O-N 3.19Å; E354-V358 VanDerWaalsContact O-N 3.12Å
355	A	51.9	Low	52	Low	53 Å²	53	101.5 Å²	101.5	44%	0.438	59%	0.591	S	S	.	*	H	α-helix	trans	-58.7	-37.2	175.3	0	0	0	0	0	113	L351 L359	L351-A355 PolarHBondContact O-N 3.48Å; A355-L359 WeakPolarHBondContact O-CG 3.32Å; A355-L359 PolarHBondContact O-N 3.35Å
356	S	54	Low	53.2	Low	67 Å²	67	100.7 Å²	100.7	47%	0.469	59%	0.588	S	S	.	*	H	α-helix	trans	-68.7	-39.5	178.5	-57.1	0	0	0	0	112	T352 A353 E354 L359 S360	T352-S356 PolarHBondContact O-N 3.2Å; T352-S356 PolarHBondContact O-OG 2.89Å; A353-S356 PolarHBondContact O-N 2.91Å; E354-S356 VanDerWaalsContact C-N 3.27Å; E354-S356 PolarHBondContact O-N 3.5Å; S356-L359 PolarHBondContact O-N 3.2Å; S356-S360 PolarHBondContact O-N 3.01Å; S356-S360 PolarHBondContact O-OG 2.84Å
357	A	59.8	Low	54.2	Low	60 Å²	60	103.8 Å²	103.8	50%	0.496	59%	0.593	S	S	.	*	H	α-helix	trans	-67	-36.3	177.2	0	0	0	0	0	112.8	A353 E354 T361	A353-A357 PolarHBondContact O-N 3.39Å; E354-A357 PolarHBondContact O-N 3.23Å; A357-T361 PolarHBondContact O-N 2.96Å; A357-T361 PolarHBondContact O-OG1 2.84Å
358	V	56.6	Low	55.2	Low	77 Å²	77	102 Å²	102	47%	0.467	57%	0.573	S	S	.	*	H	α-helix	trans	-66.9	-37.2	175.2	173.6	0	0	0	0	111.6	E354 T361 L362	E354-V358 WeakPolarHBondContact O-CG2 3.36Å; E354-V358 PolarHBondContact O-N 3.19Å; E354-V358 VanDerWaalsContact O-N 3.12Å; V358-T361 WeakPolarHBondContact CA-OG1 3.32Å; V358-T361 PolarHBondContact O-OG1 2.88Å; V358-L362 HydrophobicContact CG1-CD1 4.1Å; V358-L362 WeakPolarHBondContact O-CG 3.16Å; V358-L362 PolarHBondContact O-N 3.27Å
359	L	56	Low	56.2	Low	108 Å²	108	99.1 Å²	99.1	57%	0.565	56%	0.556	S	S	*	*	H	α-helix	trans	-68.5	-44.6	177.5	-71.2	169.5	0	0	0	112.3	A355 S356 T361 L362 Q363	A355-L359 WeakPolarHBondContact O-CG 3.32Å; A355-L359 PolarHBondContact O-N 3.35Å; S356-L359 PolarHBondContact O-N 3.2Å; L359-T361 VanDerWaalsContact C-N 3.26Å; L359-T361 PolarHBondContact O-N 3.13Å; L359-L362 PolarHBondContact O-N 2.79Å; L359-L362 VanDerWaalsContact O-N 3.15Å; L359-Q363 PolarHBondContact O-N 3.5Å; L359-Q363 VanDerWaalsContact O-N 3.15Å
360	S	60.7	Low	56.9	Low	75 Å²	75	96.8 Å²	96.8	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-63.5	-29.4	177.4	-59.8	0	0	0	0	113.6	S356	S356-S360 PolarHBondContact O-N 3.01Å; S356-S360 PolarHBondContact O-OG 2.84Å
361	T	61.9	Low	57.8	Low	93 Å²	93	91.2 Å²	91.2	57%	0.571	53%	0.529	S	S	*	.	H	α-helix	trans	-83.6	-12.6	177.3	44.2	0	0	0	0	114	A357 V358 L359 T364	A357-T361 PolarHBondContact O-N 2.96Å; A357-T361 PolarHBondContact O-OG1 2.84Å; V358-T361 WeakPolarHBondContact CA-OG1 3.32Å; V358-T361 PolarHBondContact O-OG1 2.88Å; L359-T361 VanDerWaalsContact C-N 3.26Å; L359-T361 PolarHBondContact O-N 3.13Å; T361-T364 PolarHBondContact O-OG1 3.04Å; T361-T364 VanDerWaalsContact O-OG1 3.06Å
362	L	53.4	Low	58.4	Low	62 Å²	62	88.9 Å²	88.9	33%	0.325	52%	0.515	S	S	.	.	H	α-helix	trans	-89.3	-32.3	170.9	-70.2	169.4	0	0	0	112.2	V358 L359 T364 I365 F368	V358-L362 HydrophobicContact CG1-CD1 4.1Å; V358-L362 WeakPolarHBondContact O-CG 3.16Å; V358-L362 PolarHBondContact O-N 3.27Å; L359-L362 PolarHBondContact O-N 2.79Å; L359-L362 VanDerWaalsContact O-N 3.15Å; L362-T364 PolarHBondContact O-N 2.95Å; L362-I365 HydrophobicContact CD2-CD1 4.05Å; L362-I365 WeakPolarHBondContact O-CB 3.44Å; L362-I365 PolarHBondContact O-N 3.09Å; L362-I365 VanDerWaalsContact O-N 3.1Å; L362-F368 HydrophobicContact CB-CD1 3.93Å; L362-F368 HydrophobicContact CB-CE1 3.78Å; L362-F368 HydrophobicContact CB-CZ 4.35Å; L362-F368 WeakPolarHBondContact O-CD1 3.38Å
363	Q	58.2	Low	59.1	Low	131 Å²	131	91.1 Å²	91.1	61%	0.612	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.7	175.9	-75.2	-178.6	-35.4	0	0	114.2	L359 I365	L359-Q363 PolarHBondContact O-N 3.5Å; L359-Q363 VanDerWaalsContact O-N 3.15Å; Q363-I365 VanDerWaalsContact C-N 3.27Å; Q363-I365 PolarHBondContact O-N 3.33Å
364	T	60.8	Low	59.4	Low	112 Å²	112	93.5 Å²	93.5	69%	0.687	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	1.2	173.9	47.9	0	0	0	0	114.5	T361 L362	T361-T364 PolarHBondContact O-OG1 3.04Å; T361-T364 VanDerWaalsContact O-OG1 3.06Å; L362-T364 PolarHBondContact O-N 2.95Å
365	I	70.6	Confident	59.6	Low	73 Å²	73	93.5 Å²	93.5	37%	0.374	53%	0.525	S	S	.	.	S	Bend	trans	-95.4	117	175.2	-56.9	174.2	0	0	0	108.4	L362 Q363 E367 F368 A369	L362-I365 HydrophobicContact CD2-CD1 4.05Å; L362-I365 WeakPolarHBondContact O-CB 3.44Å; L362-I365 PolarHBondContact O-N 3.09Å; L362-I365 VanDerWaalsContact O-N 3.1Å; Q363-I365 VanDerWaalsContact C-N 3.27Å; Q363-I365 PolarHBondContact O-N 3.33Å; I365-E367 PolarHBondContact O-N 3.49Å; I365-F368 HydrophobicContact CB-CB 3.94Å; I365-F368 HydrophobicContact CG2-CB 4.21Å; I365-F368 WeakPolarHBondContact O-CB 3.17Å; I365-F368 PolarHBondContact O-N 2.95Å; I365-A369 PolarHBondContact O-N 3.19Å; I365-A369 VanDerWaalsContact O-N 3.1Å
366	P	62.7	Low	59.6	Low	105 Å²	105	97.5 Å²	97.5	68%	0.682	54%	0.539	S	S	*	.	H	α-helix	trans	-56.7	-45.6	-174.5	-27.8	35.6	0	0	0	113.9	F368 A369 E370	P366-F368 PolarHBondContact O-N 3.48Å; P366-A369 PolarHBondContact O-N 3.05Å; P366-E370 PolarHBondContact O-N 3.11Å; P366-E370 VanDerWaalsContact O-N 3.14Å
367	E	61.6	Low	59.3	Low	156 Å²	156	98 Å²	98	73%	0.729	54%	0.543	S	S	*	.	H	α-helix	trans	-63.6	-20.6	177.9	-59.8	179.1	145.6	0	0	113.1	I365 T371	I365-E367 PolarHBondContact O-N 3.49Å; E367-T371 WeakPolarHBondContact O-CG2 3.25Å
368	F	64.2	Low	58.5	Low	76 Å²	76	102.6 Å²	102.6	33%	0.333	55%	0.554	S	S	.	*	H	α-helix	trans	-87.6	-38.5	176.8	-169.4	-102.8	0	0	0	111.8	L362 I365 P366 T371 M372	L362-F368 HydrophobicContact CB-CD1 3.93Å; L362-F368 HydrophobicContact CB-CE1 3.78Å; L362-F368 HydrophobicContact CB-CZ 4.35Å; L362-F368 WeakPolarHBondContact O-CD1 3.38Å; I365-F368 HydrophobicContact CB-CB 3.94Å; I365-F368 HydrophobicContact CG2-CB 4.21Å; I365-F368 WeakPolarHBondContact O-CB 3.17Å; I365-F368 PolarHBondContact O-N 2.95Å; P366-F368 PolarHBondContact O-N 3.48Å; F368-T371 PolarHBondContact O-N 2.75Å; F368-T371 PolarHBondContact O-OG1 2.74Å; F368-M372 HydrophobicContact CE1-CG 4.41Å; F368-M372 PolarHBondContact O-N 2.7Å
369	A	64.6	Low	58.3	Low	44 Å²	44	105.7 Å²	105.7	36%	0.364	58%	0.576	S	S	.	*	H	α-helix	trans	-60.3	-45.9	174.3	0	0	0	0	0	111.6	I365 P366 T371 M372 E373	I365-A369 PolarHBondContact O-N 3.19Å; I365-A369 VanDerWaalsContact O-N 3.1Å; P366-A369 PolarHBondContact O-N 3.05Å; A369-T371 VanDerWaalsContact C-N 3.28Å; A369-T371 PolarHBondContact O-N 2.98Å; A369-M372 WeakPolarHBondContact O-CB 3.22Å; A369-M372 PolarHBondContact O-N 3.13Å; A369-E373 PolarHBondContact O-N 3.39Å
370	E	61.7	Low	58	Low	126 Å²	126	103.3 Å²	103.3	59%	0.589	58%	0.578	S	S	*	*	H	α-helix	trans	-57.3	-39.5	175.4	-172.6	177.1	-176.1	0	0	111.9	P366 M372 E373 L374	P366-E370 PolarHBondContact O-N 3.11Å; P366-E370 VanDerWaalsContact O-N 3.14Å; E370-M372 VanDerWaalsContact C-N 3.33Å; E370-M372 PolarHBondContact O-N 3.2Å; E370-E373 PolarHBondContact O-N 3.2Å; E370-L374 HydrophobicContact CG-CD1 4.31Å; E370-L374 WeakPolarHBondContact O-CB 3.45Å; E370-L374 WeakPolarHBondContact O-CG 3.14Å; E370-L374 PolarHBondContact O-N 3.49Å
371	T	61.3	Low	57.5	Low	66 Å²	66	105 Å²	105	41%	0.405	59%	0.585	S	S	.	*	H	α-helix	trans	-71.8	-21.2	176.3	58.8	0	0	0	0	114.8	E367 F368 A369 L375	E367-T371 WeakPolarHBondContact O-CG2 3.25Å; F368-T371 PolarHBondContact O-N 2.75Å; F368-T371 PolarHBondContact O-OG1 2.74Å; A369-T371 VanDerWaalsContact C-N 3.28Å; A369-T371 PolarHBondContact O-N 2.98Å; T371-L375 WeakPolarHBondContact O-CD1 3.38Å; T371-L375 VanDerWaalsContact O-CG 3.25Å; T371-L375 WeakPolarHBondContact O-CG 3.46Å
372	M	62.3	Low	56.6	Low	80 Å²	80	112 Å²	112	39%	0.394	60%	0.601	S	S	.	*	H	α-helix	trans	-78.2	-44.6	171.4	-78.3	-62.4	-47.8	0	0	111.1	F368 A369 E370 L374 L375 D376	F368-M372 HydrophobicContact CE1-CG 4.41Å; F368-M372 PolarHBondContact O-N 2.7Å; A369-M372 WeakPolarHBondContact O-CB 3.22Å; A369-M372 PolarHBondContact O-N 3.13Å; E370-M372 VanDerWaalsContact C-N 3.33Å; E370-M372 PolarHBondContact O-N 3.2Å; M372-L374 PolarHBondContact O-N 2.9Å; M372-L375 PolarHBondContact O-N 2.94Å; M372-D376 PolarHBondContact O-N 3.35Å
373	E	60.7	Low	56.1	Low	147 Å²	147	116.6 Å²	116.6	69%	0.687	63%	0.626	S	S	*	*	H	α-helix	trans	-61.7	-33.9	177.8	-165.6	166.6	-160.1	0	0	112	A369 E370 L375 S377	A369-E373 PolarHBondContact O-N 3.39Å; E370-E373 PolarHBondContact O-N 3.2Å; E373-L375 VanDerWaalsContact C-N 3.35Å; E373-S377 PolarHBondContact O-OG 2.98Å
374	L	54.6	Low	55.1	Low	118 Å²	118	116.7 Å²	116.7	62%	0.618	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-18.5	170.6	-80	166.6	0	0	0	115.1	E370 M372	E370-L374 HydrophobicContact CG-CD1 4.31Å; E370-L374 WeakPolarHBondContact O-CB 3.45Å; E370-L374 WeakPolarHBondContact O-CG 3.14Å; E370-L374 PolarHBondContact O-N 3.49Å; M372-L374 PolarHBondContact O-N 2.9Å
375	L	53.7	Low	54	Low	135 Å²	135	118.1 Å²	118.1	71%	0.707	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-26.4	179.3	-78.1	170.9	0	0	0	113.3	T371 M372 E373 S377	T371-L375 WeakPolarHBondContact O-CD1 3.38Å; T371-L375 VanDerWaalsContact O-CG 3.25Å; T371-L375 WeakPolarHBondContact O-CG 3.46Å; M372-L375 PolarHBondContact O-N 2.94Å; E373-L375 VanDerWaalsContact C-N 3.35Å; L375-S377 VanDerWaalsContact C-N 3.3Å
376	D	51.5	Low	52.7	Low	136 Å²	136	118.3 Å²	118.3	73%	0.727	65%	0.652	S	S	*	*	S	Bend	trans	-86	-1	172.9	-70.1	-40	0	0	0	112.9	M372	M372-D376 PolarHBondContact O-N 3.35Å
377	S	49.6	Very low	51.5	Low	79 Å²	79	118.7 Å²	118.7	55%	0.552	66%	0.656	S	S	*	*	S	Bend	trans	-88.4	110.1	178.9	-69.5	0	0	0	0	113.4	E373 L375	E373-S377 PolarHBondContact O-OG 2.98Å; L375-S377 VanDerWaalsContact C-N 3.3Å
378	E	42.4	Very low	50	Low	155 Å²	155	120.9 Å²	120.9	72%	0.724	66%	0.664	S	S	*	*			trans	53.2	104	173.5	-72.7	-149.2	142.3	0	0	119.4	G380	E378-G380 PolarHBondContact O-N 2.86Å
379	P	51.5	Low	48.4	Very low	142 Å²	142	124 Å²	124	92%	0.922	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	32.4	169.4	35.5	-36.5	0	0	0	113.9
380	G	50.6	Low	46.9	Very low	59 Å²	59	128.1 Å²	128.1	61%	0.608	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-34.2	-165	0	0	0	0	0	117.5	E378	E378-G380 PolarHBondContact O-N 2.86Å
381	T	49.1	Very low	45.5	Very low	110 Å²	110	126.4 Å²	126.4	68%	0.675	71%	0.707	S	S	*	*	S	Bend	trans	-102.9	-7.9	-157.8	45.2	0	0	0	0	116.4	N383	T381-N383 VanDerWaalsContact C-N 3.33Å; T381-N383 PolarHBondContact O-N 2.95Å
382	W	44.6	Very low	44.1	Very low	240 Å²	240	131 Å²	131	91%	0.909	73%	0.729	S	S	*	*	S	Bend	trans	-85.9	10.9	-171.5	-75.7	87.3	0	0	0	115.9
383	N	42.2	Very low	42.5	Very low	158 Å²	158	132.6 Å²	132.6	85%	0.845	75%	0.754	S	S	*	*			trans	-125.5	54.6	-172.9	-162.1	27.2	0	0	0	114.1	T381	T381-N383 VanDerWaalsContact C-N 3.33Å; T381-N383 PolarHBondContact O-N 2.95Å
384	N	36.2	Very low	41.2	Very low	133 Å²	133	130.1 Å²	130.1	71%	0.711	76%	0.759	S	S	*	*			trans	-143.6	76.8	168.6	-156.1	-21.6	0	0	0	112.8
385	V	38.2	Very low	40.4	Very low	143 Å²	143	131 Å²	131	87%	0.867	77%	0.769	S	S	*	*			trans	-113.3	64.2	172.5	-170.9	0	0	0	0	109
386	A	43.3	Very low	39.6	Very low	77 Å²	77	130.2 Å²	130.2	64%	0.636	77%	0.772	S	S	*	*			trans	-136.4	31.5	-174.6	0	0	0	0	0	113.9
387	S	37.7	Very low	38.7	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	77%	0.774	S	S	*	*			trans	-159.5	92.9	167.1	-82.3	0	0	0	0	112.4
388	F	30	Very low	37.8	Very low	202 Å²	202	136.9 Å²	136.9	89%	0.886	79%	0.791	S	S	*	*			trans	-142.3	85.6	160.5	-94.9	-75.4	0	0	0	109
389	D	31.1	Very low	37.1	Very low	143 Å²	143	137.9 Å²	137.9	77%	0.765	80%	0.795	S	S	*	*			trans	-80.9	143.9	161.2	-174.6	11.5	0	0	0	108.9
390	V	33.2	Very low	36.2	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	78%	0.784	S	S	*	*			trans	-129.8	84.7	-173.7	-175.8	0	0	0	0	109.4
391	S	31.7	Very low	35.1	Very low	91 Å²	91	141.4 Å²	141.4	64%	0.636	79%	0.794	S	S	*	*			trans	-129.1	119.4	176.8	-72.3	0	0	0	0	111.9
392	N	31.2	Very low	34.1	Very low	163 Å²	163	140.9 Å²	140.9	87%	0.872	80%	0.8	S	S	*	*			trans	47.8	92.1	160.8	-64.5	-18.8	0	0	0	119.4
393	A	29.6	Very low	33.3	Very low	112 Å²	112	132.9 Å²	132.9	93%	0.926	79%	0.792	S	S	*	*			trans	-93	96.4	156.3	0	0	0	0	0	110.8
394	A	32.9	Very low	32.6	Very low	95 Å²	95	135 Å²	135	79%	0.785	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-85.3	161.2	166.9	0	0	0	0	0	111.1
395	T	38	Very low	32.2	Very low	137 Å²	137	134.2 Å²	134.2	84%	0.84	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.3	137.5	-170.2	42.8	0	0	0	0	115
396	P	36.3	Very low	31.7	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75	164.6	167.9	32.6	-34.5	0	0	0	112.6
397	P	33.4	Very low	31	Very low	117 Å²	117	136.9 Å²	136.9	76%	0.76	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-95.5	160.1	-154.7	36.3	-37.3	0	0	0	116
398	R	30.9	Very low	30.4	Very low	239 Å²	239	138.2 Å²	138.2	90%	0.902	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.7	144.5	154.7	-66.9	-178.9	176.2	-173.1	-1.5	109.7
399	H	28.5	Very low	30.3	Very low	175 Å²	175	135.4 Å²	135.4	81%	0.81	78%	0.78	S	S	*	*			trans	-140.3	145.8	160.5	-116.6	-89.1	0	0	0	110.6
400	S	31.9	Very low	30.1	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	77%	0.771	S	S	*	*			trans	-131.9	136.3	-168.4	-50.9	0	0	0	0	111.8
401	H	28	Very low	29.9	Very low	175 Å²	175	137.2 Å²	137.2	81%	0.81	77%	0.768	S	S	*	*			trans	-146.7	125	158.5	-75.3	-71.4	0	0	0	106.2
402	A	27.8	Very low	29.7	Very low	99 Å²	99	138 Å²	138	82%	0.818	77%	0.769	S	S	*	*				71.8	122.9	67.1	0	0	0	0	0	112.8
403	G	26.8	Very low	29.6	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	76%	0.76	S	S	*	*			cis	165.9	-169.7	-6.8	0	0	0	0	0	113.8
404	F	27.8	Very low	29.4	Very low	202 Å²	202	140.5 Å²	140.5	89%	0.886	76%	0.756	S	S	*	*			trans	79	154.9	164	-107	-90.9	0	0	0	121.7
405	T	28.2	Very low	29.2	Very low	117 Å²	117	144 Å²	144	72%	0.718	76%	0.756	S	S	*	*			trans	74.8	141.9	175.3	79.9	0	0	0	0	115.3
406	N	27.8	Very low	30.1	Very low	141 Å²	141	142 Å²	142	75%	0.754	75%	0.745	S	S	*	*			cis	-160.3	176.5	-4.4	-138	-24.8	0	0	0	113.9
407	L	27.6	Very low	29.8	Very low	135 Å²	135	142 Å²	142	71%	0.707	74%	0.743	S	S	*	*			trans	74.3	122.7	158.7	-66.2	170.5	0	0	0	121.4
408	L	26.3	Very low	29.4	Very low	141 Å²	141	139.4 Å²	139.4	74%	0.738	74%	0.737	S	S	*	*				34.4	152.8	121.4	-87.5	82.4	0	0	0	122.1
409	Q	27.8	Very low	29.3	Very low	142 Å²	142	138 Å²	138	66%	0.664	73%	0.734	S	S	*	*			cis	173.3	163.5	-20.1	150	174.7	-15.3	0	0	108.7
410	E	26.8	Very low	29.3	Very low	125 Å²	125	135.5 Å²	135.5	58%	0.584	73%	0.731	S	S	*	*			trans	76.7	148	171.9	-55.4	-123.9	145.8	0	0	117.1
411	R	29.4	Very low	29.1	Very low	186 Å²	186	136.2 Å²	136.2	70%	0.702	73%	0.731	S	S	*	*			cis	-153.6	153.5	-13.9	-126.1	-171.2	170.9	115.7	-1.7	111.8
412	T	27.7	Very low	29.4	Very low	108 Å²	108	134.3 Å²	134.3	66%	0.663	73%	0.726	S	S	*	*			trans	4.9	154.9	144.4	58	0	0	0	0	120.7
413	V	28.1	Very low	29.6	Very low	113 Å²	113	135.2 Å²	135.2	69%	0.685	72%	0.718	S	S	*	*			cis	-140.5	-154.5	21.8	-133.3	0	0	0	0	110
414	Y	25.7	Very low	29.8	Very low	213 Å²	213	139 Å²	139	84%	0.835	72%	0.716	S	S	*	*			cis	-151.2	-178.6	8.6	-125.1	-63	0	0	0	110.4
415	E	27.8	Very low	30.2	Very low	168 Å²	168	135.3 Å²	135.3	79%	0.785	71%	0.71	S	S	*	*			trans	-145.8	-161.4	172.6	-133.5	-147.5	154.2	0	0	107.2
416	P	57.5	Low	30.2	Very low	96 Å²	96	134.1 Å²	134.1	62%	0.623	71%	0.712	S	S	*	*			cis	-132.4	-146.4	-14.6	40.1	-18.9	0	0	0	113.2
417	V	29.8	Very low	30.2	Very low	117 Å²	117	135 Å²	135	71%	0.709	71%	0.713	S	S	*	*			trans	88	128.2	176.6	-171.6	0	0	0	0	113	Y419	V417-Y419 HydrophobicContact CG1-CD2 4.34Å; V417-Y419 HydrophobicContact CG1-CE2 3.72Å
418	G	25.7	Very low	31.1	Very low	63 Å²	63	133.9 Å²	133.9	65%	0.649	71%	0.714	S	S	*	*			cis	126.7	138.5	21.3	0	0	0	0	0	107.6
419	Y	27.7	Very low	31.3	Very low	210 Å²	210	129.9 Å²	129.9	82%	0.824	71%	0.707	S	S	*	*			cis	-153.8	163.3	27.8	-65.2	-97.7	0	0	0	113.9	V417	V417-Y419 HydrophobicContact CG1-CD2 4.34Å; V417-Y419 HydrophobicContact CG1-CE2 3.72Å
420	T	29.2	Very low	31.7	Very low	123 Å²	123	130 Å²	130	76%	0.755	71%	0.707	S	S	*	*			trans	-33	159.5	162.4	52.7	0	0	0	0	119.2
421	V	28.5	Very low	31.8	Very low	115 Å²	115	131.3 Å²	131.3	70%	0.697	72%	0.718	S	S	*	*				-174.2	144.9	69.5	160.8	0	0	0	0	113.1
422	N	33.8	Very low	31.9	Very low	134 Å²	134	126 Å²	126	72%	0.717	72%	0.721	S	S	*	*			trans	24.2	150	151	-55.4	4.1	0	0	0	122.9
423	N	31.6	Very low	32	Very low	119 Å²	119	128.6 Å²	128.6	64%	0.636	73%	0.731	S	S	*	*			cis	-159.5	-150.1	-5.1	-90.3	-8.1	0	0	0	107.5
424	H	31.5	Very low	32	Very low	152 Å²	152	128.4 Å²	128.4	70%	0.704	73%	0.733	S	S	*	*			cis	-156.4	147.9	3.9	-107.2	-57	0	0	0	109
425	T	35.8	Very low	32.9	Very low	124 Å²	124	123.7 Å²	123.7	76%	0.761	73%	0.729	S	S	*	*				54.1	123	95.4	-41.2	0	0	0	0	115.6
426	A	28.2	Very low	33	Very low	92 Å²	92	122.4 Å²	122.4	76%	0.76	73%	0.727	S	S	*	*			cis	-145.1	177	38.9	0	0	0	0	0	117.5
427	M	28.3	Very low	31.6	Very low	159 Å²	159	127.3 Å²	127.3	78%	0.783	74%	0.739	S	S	*	*			trans	-110.3	-172	177.6	-83.5	-72.1	-77.2	0	0	110.4
428	P	46.9	Very low	31.4	Very low	111 Å²	111	125 Å²	125	72%	0.721	74%	0.739	S	S	*	*			cis	-122.5	174.8	-0.5	40.1	-24.1	0	0	0	114.6
429	G	29.8	Very low	31.5	Very low	57 Å²	57	129.8 Å²	129.8	59%	0.588	75%	0.749	S	S	*	*			cis	-170.2	-143.2	8.2	0	0	0	0	0	109.2
430	H	36.2	Very low	31.5	Very low	145 Å²	145	126 Å²	126	67%	0.671	75%	0.747	S	S	*	*			cis	179.5	136.8	-19.5	-92.4	-55.2	0	0	0	106.1
431	D	28.8	Very low	31.5	Very low	153 Å²	153	124.1 Å²	124.1	82%	0.818	74%	0.744	S	S	*	*			cis	-130.8	-91.5	-14.8	-76.7	-51.4	0	0	0	111.9
432	G	30.6	Very low	31.7	Very low	74 Å²	74	125.1 Å²	125.1	76%	0.763	75%	0.751	S	S	*	*			cis	146.9	126.8	-7.2	0	0	0	0	0	111.9
433	N	30	Very low	31.6	Very low	163 Å²	163	124.6 Å²	124.6	87%	0.872	75%	0.752	S	S	*	*			cis	-147.2	162	-8.1	-161.5	18	0	0	0	112.2
434	C	28	Very low	31.6	Very low	108 Å²	108	123.6 Å²	123.6	73%	0.73	75%	0.754	S	S	*	*			trans	-116.8	-168.9	176.2	-66.6	0	0	0	0	110
435	P	45.5	Very low	31.5	Very low	115 Å²	115	125 Å²	125	75%	0.747	76%	0.761	S	S	*	*			cis	-144.9	177	0.8	46.7	-28	0	0	0	118.1
436	L	28.9	Very low	31.3	Very low	141 Å²	141	124.3 Å²	124.3	74%	0.738	76%	0.762	S	S	*	*			trans	48.9	141.3	133.2	-165.6	68	0	0	0	125.4
437	F	29.1	Very low	32.6	Very low	198 Å²	198	125 Å²	125	87%	0.868	76%	0.759	S	S	*	*			trans	73.9	133.4	159.6	-84.9	-52.5	0	0	0	122.4
438	G	25.3	Very low	33.2	Very low	70 Å²	70	124.7 Å²	124.7	72%	0.722	76%	0.758	S	S	*	*			trans	122.6	98.9	134.4	0	0	0	0	0	122.6
439	L	28.1	Very low	32.8	Very low	162 Å²	162	126.1 Å²	126.1	85%	0.848	76%	0.759	S	S	*	*			trans	44.7	125.6	131.6	-86.9	165.9	0	0	0	125.3
440	V	26.6	Very low	33.2	Very low	130 Å²	130	130.3 Å²	130.3	79%	0.788	77%	0.768	S	S	*	*			trans	60.7	118.2	148.5	-80.5	0	0	0	0	126.4
441	A	29.8	Very low	33.2	Very low	85 Å²	85	127.7 Å²	127.7	70%	0.702	77%	0.766	S	S	*	*				88.6	134.8	115.4	0	0	0	0	0	125.4
442	V	32.3	Very low	33.5	Very low	136 Å²	136	127.7 Å²	127.7	82%	0.824	77%	0.765	S	S	*	*			trans	75.5	144.3	139.3	162.4	0	0	0	0	117.1
443	T	33.1	Very low	33.8	Very low	123 Å²	123	133 Å²	133	76%	0.755	77%	0.767	S	S	*	*			cis	-142.5	146.4	15.1	-25.8	0	0	0	0	112.9
444	S	31.2	Very low	35.2	Very low	97 Å²	97	131.2 Å²	131.2	68%	0.678	76%	0.764	S	S	*	*			trans	171.3	157.7	141.9	-86.7	0	0	0	0	111.2
445	Q	29.8	Very low	35.6	Very low	181 Å²	181	129.3 Å²	129.3	85%	0.846	76%	0.763	S	S	*	*			cis	-160.5	157.9	-28.9	-115	179	93.8	0	0	108.1
446	S	31.3	Very low	35.4	Very low	111 Å²	111	132.3 Å²	132.3	78%	0.776	76%	0.764	S	S	*	*			trans	-163.9	158.4	169.3	68.2	0	0	0	0	110.1
447	P	56	Low	35.6	Very low	107 Å²	107	131.4 Å²	131.4	70%	0.695	76%	0.76	S	S	*	*				-152.6	-162.4	94.1	42	-24.2	0	0	0	114.1
448	I	39.1	Very low	36.2	Very low	151 Å²	151	126.6 Å²	126.6	77%	0.774	75%	0.751	S	S	*	*			trans	72.7	157.2	157.2	-80.6	170.7	0	0	0	116.7
449	I	38.6	Very low	36.6	Very low	142 Å²	142	129.1 Å²	129.1	73%	0.728	76%	0.758	S	S	*	*			cis	-167	156.1	-47.3	-139.7	175.4	0	0	0	106
450	N	38	Very low	36.7	Very low	145 Å²	145	124.1 Å²	124.1	78%	0.775	75%	0.745	S	S	*	*			cis	-138.5	-156	-1.9	-154.6	-0.6	0	0	0	105.9
451	S	36.8	Very low	37	Very low	90 Å²	90	129.7 Å²	129.7	63%	0.629	75%	0.752	S	S	*	*			cis	-158.7	-171.3	-4.9	62.4	0	0	0	0	106.6
452	L	34.7	Very low	37.3	Very low	153 Å²	153	134.9 Å²	134.9	80%	0.801	76%	0.759	S	S	*	*			cis	-143.4	-146.8	-0.8	-142.2	177.7	0	0	0	107.8
453	K	38.1	Very low	37.3	Very low	185 Å²	185	137 Å²	137	80%	0.804	76%	0.757	S	S	*	*			trans	-154.5	167.2	-174.2	-77.4	-165.2	-178.9	175.5	0	112.5
454	P	59.5	Low	37.2	Very low	125 Å²	125	140.7 Å²	140.7	81%	0.812	76%	0.757	S	S	*	*			cis	-80.4	-167.6	3.3	37.8	-39.4	0	0	0	113
455	G	34.9	Very low	37.1	Very low	69 Å²	69	147 Å²	147	71%	0.711	77%	0.766	S	S	*	*			cis	179.8	-154.7	3.7	0	0	0	0	0	108.4
456	K	42.4	Very low	37.1	Very low	177 Å²	177	142.2 Å²	142.2	77%	0.77	77%	0.766	S	S	*	*			cis	-175.3	148.5	-38.2	-99.6	-163.5	163.5	-85.9	0	104.9
457	D	33.5	Very low	37	Very low	122 Å²	122	146.6 Å²	146.6	65%	0.652	77%	0.765	S	S	*	*			cis	-166.5	155.8	-18.1	-101.3	-11.1	0	0	0	106.4
458	S	41.2	Very low	35.6	Very low	98 Å²	98	151 Å²	151	69%	0.685	77%	0.768	S	S	*	*			cis	-166.2	-139.4	-14.6	63.5	0	0	0	0	108.5
459	S	33.4	Very low	35	Very low	123 Å²	123	152.1 Å²	152.1	86%	0.86	77%	0.77	S	S	*	*			trans	70	-164.2	169.1	91.4	0	0	0	0	114.9
460	G	30	Very low	35.8	Very low	57 Å²	57	150 Å²	150	59%	0.588	77%	0.765	S	S	*	*			cis	-127.3	-26.5	4.4	0	0	0	0	0	117.7
461	R	34	Very low	35.1	Very low	247 Å²	247	150.4 Å²	150.4	93%	0.932	77%	0.766	S	S	*	*			trans	80.2	174.2	176.8	-52.7	170.7	171.4	-175.1	-2.1	117.4
462	K	34.6	Very low	34.5	Very low	193 Å²	193	150.6 Å²	150.6	84%	0.839	77%	0.767	S	S	*	*				-175.6	139.4	-55.1	-146.2	166.8	-173.8	166.7	0	112.2
463	K	32.7	Very low	34.1	Very low	180 Å²	180	148.8 Å²	148.8	78%	0.783	76%	0.758	S	S	*	*			trans	86.2	117.4	141.9	-134.1	-176.2	-175.6	-179.9	0	123.5
464	R	30.4	Very low	33.7	Very low	202 Å²	202	149.9 Å²	149.9	76%	0.762	76%	0.757	S	S	*	*			trans	76.5	137	136.6	-106.4	-169.5	178.1	-172.7	0.8	125.6
465	R	30.2	Very low	32.3	Very low	229 Å²	229	149.4 Å²	149.4	86%	0.864	75%	0.752	S	S	*	*			trans	74.1	127.5	144.8	-91.1	-172.2	171.1	-177.2	-3.5	120.6
466	G	29.9	Very low	31.9	Very low	81 Å²	81	151.2 Å²	151.2	84%	0.835	75%	0.753	S	S	*	*			trans	173.8	157.8	169.9	0	0	0	0	0	113
467	R	28.6	Very low	31.2	Very low	203 Å²	203	147.3 Å²	147.3	77%	0.766	75%	0.747	S	S	*	*			trans	-154.4	147.2	-137	-173.8	-152.4	-154	-78.1	7.4	111.1
468	R	27.1	Very low	30.9	Very low	199 Å²	199	146.8 Å²	146.8	75%	0.751	75%	0.753	S	S	*	*			trans	71.8	136	-177.4	-49	177.4	-176.4	-104.3	8.4	112.2
469	Q	26.3	Very low	30.2	Very low	175 Å²	175	151.5 Å²	151.5	82%	0.818	76%	0.762	S	S	*	*			cis	77.7	153.5	28	-142.6	-142	-2.4	0	0	113.1
470	P	56.1	Low	30	Very low	96 Å²	96	152.2 Å²	152.2	62%	0.623	76%	0.755	S	S	*	*				-121.6	-158.9	-82.6	42.8	-27.8	0	0	0	110.9
471	L	23.7	Very low	30.1	Very low	154 Å²	154	157 Å²	157	81%	0.806	76%	0.763	S	S	*	*			trans	-176.7	126.9	141.8	-90.6	150.3	0	0	0	106.3
472	C	23.9	Very low	29.8	Very low	95 Å²	95	152 Å²	152	64%	0.642	75%	0.754	S	S	*	*				62.4	145.1	92.8	105	0	0	0	0	114
473	D	25.9	Very low	29.5	Very low	114 Å²	114	150.7 Å²	150.7	61%	0.61	75%	0.753	S	S	*	*			cis	-143.7	154.8	12.4	-113.1	-35.4	0	0	0	109.4
474	R	29.3	Very low	29.4	Very low	208 Å²	208	147.2 Å²	147.2	79%	0.785	75%	0.751	S	S	*	*				59.1	129.2	96.4	-140.2	172.3	-179.1	173.2	-1.7	112.4
475	T	30.2	Very low	29.2	Very low	115 Å²	115	144.6 Å²	144.6	71%	0.706	75%	0.753	S	S	*	*			cis	-153.1	143.1	41.1	-38	0	0	0	0	106.1
476	C	27.2	Very low	29.2	Very low	108 Å²	108	139.2 Å²	139.2	73%	0.73	75%	0.75	S	S	*	*				45.2	136.1	73.4	-85.8	0	0	0	0	112.7
477	S	26.6	Very low	29.9	Very low	94 Å²	94	140.8 Å²	140.8	66%	0.657	75%	0.746	S	S	*	*			cis	-160.4	-177.5	5.2	-90.5	0	0	0	0	109.7
478	S	27.4	Very low	30	Very low	111 Å²	111	140.9 Å²	140.9	78%	0.776	75%	0.751	S	S	*	*			trans	71	145.3	152.5	52.8	0	0	0	0	117.9
479	F	26.8	Very low	30.4	Very low	197 Å²	197	141.2 Å²	141.2	86%	0.864	76%	0.758	S	S	*	*			cis	-147.8	178	0.8	-143.8	-128.9	0	0	0	111.8
480	L	29.6	Very low	30.8	Very low	139 Å²	139	138.9 Å²	138.9	73%	0.728	76%	0.756	S	S	*	*			trans	-68.2	171.2	161.3	-65.4	160.5	0	0	0	108.8
481	E	32.4	Very low	30	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	77%	0.766	S	S	*	*			cis	-169.6	164.4	33.8	-156.8	166.7	-163.6	0	0	113.8
482	N	27.1	Very low	30.3	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	77%	0.767	S	S	*	*			trans	79.7	159.1	146.9	-124.3	-28.1	0	0	0	121.7
483	M	28.6	Very low	30.7	Very low	166 Å²	166	143.1 Å²	143.1	82%	0.818	77%	0.772	S	S	*	*			trans	-132.1	153.7	-172.3	-45	-179.8	80.6	0	0	110.9
484	S	29.3	Very low	30.9	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	78%	0.778	S	S	*	*			trans	177.7	120.4	135.7	-85.9	0	0	0	0	115.3
485	N	26.9	Very low	31.1	Very low	147 Å²	147	142 Å²	142	79%	0.786	78%	0.777	S	S	*	*			trans	57.2	103.3	136.3	-54	-35.9	0	0	0	122.1
486	S	29.5	Very low	31.1	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	79%	0.785	S	S	*	*				17.1	163.9	119.3	-71.1	0	0	0	0	122.6
487	P	44.5	Very low	31.1	Very low	115 Å²	115	143.5 Å²	143.5	75%	0.747	79%	0.792	S	S	*	*			cis	-139.2	156.4	-26.6	36.8	-20.4	0	0	0	114.3
488	K	31.3	Very low	31.4	Very low	204 Å²	204	143.2 Å²	143.2	89%	0.887	80%	0.795	S	S	*	*			trans	-143.2	114.2	171.8	-68.7	-176.1	-176.7	167.9	0	116
489	K	35.1	Very low	31.5	Very low	207 Å²	207	144.9 Å²	144.9	90%	0.9	80%	0.801	S	S	*	*			trans	53.5	116	144.7	-58.4	-174.1	178.3	-175	0	120.9
490	T	35.7	Very low	31.9	Very low	126 Å²	126	141 Å²	141	77%	0.773	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-94.2	144.1	158.7	50.1	0	0	0	0	112
491	P	38.4	Very low	32.1	Very low	129 Å²	129	139.2 Å²	139.2	84%	0.838	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-88.5	125.9	167.6	33.1	-30.3	0	0	0	111.9
492	T	30.8	Very low	32.1	Very low	134 Å²	134	141.2 Å²	141.2	82%	0.822	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-95.9	131.4	175	-49.7	0	0	0	0	110
493	K	33.1	Very low	32.3	Very low	170 Å²	170	140.5 Å²	140.5	74%	0.739	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97.3	125	-179.3	-150.7	173.6	-170.4	-176.8	0	111.3	Y495	K493-Y495 HydrophobicContact CD-CE2 4.08Å; K493-Y495 VanDerWaalsContact CE-OH 3.31Å; K493-Y495 WeakPolarHBondContact CE-OH 3.45Å; K493-Y495 HydrophobicContact CG-CE2 4.13Å; K493-Y495 PolarHBondContact NZ-OH 2.79Å
494	S	29.6	Very low	32.3	Very low	106 Å²	106	139 Å²	139	74%	0.741	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-99.6	149.6	178.7	50.9	0	0	0	0	112.2
495	Y	33.3	Very low	32.3	Very low	192 Å²	192	140.7 Å²	140.7	75%	0.753	81%	0.809	S	S	*	*			trans	-140	146	166.5	-76.7	-77	0	0	0	110.6	K493	K493-Y495 HydrophobicContact CD-CE2 4.08Å; K493-Y495 VanDerWaalsContact CE-OH 3.31Å; K493-Y495 WeakPolarHBondContact CE-OH 3.45Å; K493-Y495 HydrophobicContact CG-CE2 4.13Å; K493-Y495 PolarHBondContact NZ-OH 2.79Å
496	S	29.3	Very low	32.5	Very low	127 Å²	127	139 Å²	139	89%	0.888	81%	0.808	S	S	*	*			trans	-91.9	-174.6	-177	43.9	0	0	0	0	112.7
497	C	29.1	Very low	32.6	Very low	129 Å²	129	137.4 Å²	137.4	87%	0.872	80%	0.803	S	S	*	*			trans	-133	173	-162.9	-165.8	0	0	0	0	112.9
498	A	32.2	Very low	32	Very low	88 Å²	88	138 Å²	138	73%	0.727	80%	0.804	S	S	*	*			trans	74.8	148.5	177.9	0	0	0	0	0	114.3
499	T	28.5	Very low	32.1	Very low	145 Å²	145	136 Å²	136	89%	0.89	80%	0.798	S	S	*	*			cis	-132.4	170.8	37.5	49.2	0	0	0	0	116.2
500	S	34.8	Very low	32.1	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	79%	0.791	S	S	*	*			trans	-120.3	140.3	169.3	55.7	0	0	0	0	110.4
501	A	34.9	Very low	32.2	Very low	100 Å²	100	133.3 Å²	133.3	83%	0.826	79%	0.787	S	S	*	*			trans	-144.8	154	170.5	0	0	0	0	0	111.3
502	F	33	Very low	31.7	Very low	201 Å²	201	133 Å²	133	88%	0.882	78%	0.779	S	S	*	*			trans	-95.5	162.7	-176.5	-82.1	-110.5	0	0	0	112.6
503	C	29.6	Very low	31.9	Very low	125 Å²	125	132.2 Å²	132.2	85%	0.845	77%	0.769	S	S	*	*			trans	-161.6	168.6	134.8	-124.7	0	0	0	0	113.4
504	N	28.8	Very low	31.8	Very low	134 Å²	134	132.9 Å²	132.9	72%	0.717	78%	0.775	S	S	*	*			trans	-162.3	164	-165	-105.5	-10.1	0	0	0	109.6
505	I	30.9	Very low	32.2	Very low	143 Å²	143	134.4 Å²	134.4	73%	0.733	78%	0.775	S	S	*	*			cis	-167	133	-11.1	175.7	169.2	0	0	0	110.3
506	S	29.5	Very low	33	Very low	111 Å²	111	130.3 Å²	130.3	78%	0.776	77%	0.771	S	S	*	*			trans	-161.3	141.2	149.3	53.7	0	0	0	0	110.2
507	A	33	Very low	33	Very low	83 Å²	83	128.9 Å²	128.9	69%	0.686	77%	0.768	S	S	*	*			cis	85.9	149	27.9	0	0	0	0	0	114.8
508	T	30.4	Very low	33.2	Very low	127 Å²	127	131 Å²	131	78%	0.779	77%	0.769	S	S	*	*			trans	81.5	124.6	-179.1	-47.5	0	0	0	0	115.4
509	E	34	Very low	33.1	Very low	162 Å²	162	133.3 Å²	133.3	76%	0.757	78%	0.775	S	S	*	*			cis	-156.6	160.8	-12.6	-112.7	178.6	-175.3	0	0	111.6
510	L	35.2	Very low	33.3	Very low	142 Å²	142	132 Å²	132	74%	0.743	77%	0.771	S	S	*	*			trans	20.8	145.9	147	-49.7	167.6	0	0	0	120.9
511	L	38.1	Very low	33.3	Very low	134 Å²	134	133 Å²	133	70%	0.702	77%	0.773	S	S	*	*			cis	-167.1	179.6	-7.9	-104.6	172.1	0	0	0	106	L513	L511-L513 HydrophobicContact CD2-CB 4.42Å
512	N	28.4	Very low	34	Very low	123 Å²	123	134.1 Å²	134.1	66%	0.658	77%	0.772	S	S	*	*			cis	-117.7	176.5	-0	-117.9	45.4	0	0	0	108.3
513	L	34.9	Very low	33.8	Very low	118 Å²	118	131.7 Å²	131.7	62%	0.618	77%	0.773	S	S	*	*			cis	89.5	99.7	12.2	-162.3	74.4	0	0	0	118.5	L511	L511-L513 HydrophobicContact CD2-CB 4.42Å
514	E	30.4	Very low	33.8	Very low	183 Å²	183	132 Å²	132	86%	0.855	78%	0.775	S	S	*	*			trans	-152.5	145.9	137.5	-147.3	76.8	-108.2	0	0	106.4
515	D	38.8	Very low	33.8	Very low	139 Å²	139	128.8 Å²	128.8	74%	0.743	77%	0.773	S	S	*	*			trans	-135.5	-169.7	-163.2	-142.4	19	0	0	0	109.8
516	P	48.5	Very low	33.7	Very low	105 Å²	105	129.5 Å²	129.5	68%	0.682	77%	0.774	S	S	*	*			cis	-130.4	-174.4	-14.2	41.9	-25.5	0	0	0	114.2
517	A	30.1	Very low	33.7	Very low	98 Å²	98	134.6 Å²	134.6	81%	0.81	78%	0.776	S	S	*	*			trans	-120.2	141.4	166.7	0	0	0	0	0	111.9
518	L	33.3	Very low	33.3	Very low	173 Å²	173	136.8 Å²	136.8	91%	0.906	78%	0.784	S	S	*	*			trans	-111.5	137.6	178.5	-71.2	177.3	0	0	0	112.8
519	T	29.7	Very low	33.3	Very low	137 Å²	137	138.7 Å²	138.7	84%	0.84	79%	0.789	S	S	*	*			trans	-155.9	125.1	164.8	-178.4	0	0	0	0	111.7
520	S	33.1	Very low	32.9	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	80%	0.796	S	S	*	*			trans	175.3	150.5	140.7	38.9	0	0	0	0	110.7
521	T	34.4	Very low	32.5	Very low	138 Å²	138	137.4 Å²	137.4	85%	0.847	80%	0.795	S	S	*	*			trans	-109.5	161	180	30.4	0	0	0	0	111.7
522	P	50.1	Low	32.2	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	80%	0.795	S	S	*	*			trans	-91.9	172.2	-155.1	36.4	-38.7	0	0	0	115.7
523	V	28.3	Very low	32.7	Very low	150 Å²	150	136.3 Å²	136.3	91%	0.909	80%	0.801	S	S	*	*			trans	-105.3	156.9	167.9	178	0	0	0	0	110
524	C	29.3	Very low	32.4	Very low	132 Å²	132	138.3 Å²	138.3	89%	0.892	81%	0.812	S	S	*	*			trans	-106.6	141.3	-158.6	-177.4	0	0	0	0	115.1
525	G	30	Very low	32.3	Very low	66 Å²	66	137.6 Å²	137.6	68%	0.68	81%	0.813	S	S	*	*			trans	126	147.5	161.8	0	0	0	0	0	114.3
526	Q	28.3	Very low	31.9	Very low	158 Å²	158	138.7 Å²	138.7	74%	0.738	81%	0.811	S	S	*	*			cis	-163.2	155.4	-1.4	-136.8	-169.1	27.6	0	0	112.5
527	R	29.3	Very low	30.9	Very low	218 Å²	218	140.4 Å²	140.4	82%	0.823	81%	0.81	S	S	*	*			trans	65.2	105.3	160.2	-68.4	-173	-88.5	172.7	-2.9	119.4
528	C	25.6	Very low	31	Very low	128 Å²	128	142.9 Å²	142.9	87%	0.865	81%	0.809	S	S	*	*			trans	-67.3	153.5	148.4	-60.2	0	0	0	0	111.2
529	L	29.6	Very low	30.8	Very low	167 Å²	167	141 Å²	141	87%	0.874	81%	0.805	S	S	*	*			trans	-98.1	134.2	159.1	-66.4	172.9	0	0	0	109
530	L	25.7	Very low	31.5	Very low	174 Å²	174	139.4 Å²	139.4	91%	0.911	80%	0.797	S	S	*	*			trans	-168.4	111.9	143.4	-109.1	166.9	0	0	0	111
531	S	26.4	Very low	31.4	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	80%	0.8	S	S	*	*			trans	-113.5	139.5	149.3	-172.5	0	0	0	0	104.3
532	T	32.6	Very low	31.1	Very low	114 Å²	114	144.3 Å²	144.3	70%	0.699	79%	0.794	S	S	*	*				-155.5	176.8	64.6	50.2	0	0	0	0	110.6
533	P	39	Very low	30.3	Very low	120 Å²	120	144.4 Å²	144.4	78%	0.779	79%	0.787	S	S	*	*				-133.1	146.8	95.3	37.7	-29.5	0	0	0	115.3
534	L	28	Very low	30.5	Very low	160 Å²	160	144.6 Å²	144.6	84%	0.838	78%	0.776	S	S	*	*			trans	9	119.9	148.9	-70.2	145.8	0	0	0	119.2
535	L	28.3	Very low	30.5	Very low	168 Å²	168	144.8 Å²	144.8	88%	0.88	76%	0.763	S	S	*	*				-151.8	168.9	112.8	-145.2	62.4	0	0	0	112.1
536	K	30.4	Very low	30.5	Very low	161 Å²	161	147.5 Å²	147.5	70%	0.7	76%	0.762	S	S	*	*			trans	-70.8	176.9	173.7	-48.6	-178.7	179.4	177.6	0	111
537	E	28.4	Very low	30.7	Very low	141 Å²	141	147.7 Å²	147.7	66%	0.659	77%	0.769	S	S	*	*			cis	-161.3	-178	22.2	-147.4	136.3	-159.9	0	0	111.7
538	N	32.1	Very low	30.7	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	76%	0.76	S	S	*	*			trans	73.1	102.6	163.2	-60	-26.3	0	0	0	120.4
539	T	28.8	Very low	30.9	Very low	134 Å²	134	139.8 Å²	139.8	82%	0.822	76%	0.758	S	S	*	*			trans	-77.5	-168.7	149.2	58.7	0	0	0	0	109.7
540	P	43.6	Very low	31.1	Very low	103 Å²	103	143 Å²	143	67%	0.669	76%	0.758	S	S	*	*			cis	-133.2	175.3	-7.7	42.2	-26.9	0	0	0	115.3
541	K	31.1	Very low	31.7	Very low	204 Å²	204	141 Å²	141	89%	0.887	75%	0.753	S	S	*	*			trans	159.6	153.8	146.3	-86.6	148.7	-167.9	172.4	0	109.9
542	H	28.8	Very low	32.5	Very low	155 Å²	155	141.7 Å²	141.7	72%	0.718	76%	0.756	S	S	*	*			cis	-172.7	143.8	-27.7	-177.1	-135.3	0	0	0	108.1
543	L	32.2	Very low	33	Very low	125 Å²	125	145.7 Å²	145.7	65%	0.654	76%	0.763	S	S	*	*			trans	67.3	142.2	176.2	-62.7	169.9	0	0	0	115.8
544	K	32.4	Very low	32.6	Very low	154 Å²	154	148.4 Å²	148.4	67%	0.67	77%	0.771	S	S	*	*				69.4	136.9	55	-88.5	179.9	152.1	-126.1	0	112.2
545	E	30.3	Very low	32.8	Very low	136 Å²	136	146 Å²	146	64%	0.636	76%	0.762	S	S	*	*			cis	-152.8	175	9.4	-146.5	147.1	-179.1	0	0	114.4
546	N	29.8	Very low	33.5	Very low	123 Å²	123	146.6 Å²	146.6	66%	0.658	76%	0.758	S	S	*	*			trans	-44.7	175	-173	-58.7	-30.2	0	0	0	121.5
547	D	32.2	Very low	33.6	Very low	163 Å²	163	146.2 Å²	146.2	87%	0.872	76%	0.763	S	S	*	*			trans	76.4	157.2	148.6	-69.1	-48.6	0	0	0	119.5
548	G	30	Very low	33.7	Very low	62 Å²	62	143.6 Å²	143.6	64%	0.639	77%	0.766	S	S	*	*			trans	165.6	-47.4	151.7	0	0	0	0	0	118.1
549	S	28.5	Very low	33.7	Very low	118 Å²	118	141.2 Å²	141.2	83%	0.825	77%	0.767	S	S	*	*			trans	65.8	162.4	176.6	83	0	0	0	0	119.3
550	R	33.8	Very low	33.8	Very low	233 Å²	233	141.8 Å²	141.8	88%	0.879	77%	0.77	S	S	*	*			trans	72.7	97.5	142.8	-153.3	175.8	-160.3	-179.4	5.3	120.4
551	T	38.4	Very low	33.9	Very low	132 Å²	132	142.2 Å²	142.2	81%	0.81	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.2	142.8	161.4	-23.9	0	0	0	0	112.9
552	P	44	Very low	33.9	Very low	119 Å²	119	139.1 Å²	139.1	77%	0.773	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-100.2	148.3	156.5	35	-29.1	0	0	0	112.1
553	K	42.2	Very low	34.4	Very low	199 Å²	199	137.6 Å²	137.6	87%	0.865	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-102.8	147.3	172	-62.8	175.1	-179	175.3	0	109.9
554	L	31.8	Very low	34.8	Very low	177 Å²	177	143.5 Å²	143.5	93%	0.927	79%	0.788	S	S	*	*			trans	-145	158	164	-110.6	166.7	0	0	0	111.3
555	V	32.2	Very low	35.1	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.655	79%	0.794	S	S	*	*			trans	-147	125.8	-146.7	174.6	0	0	0	0	113.8
556	K	43.5	Very low	35.7	Very low	182 Å²	182	141.9 Å²	141.9	79%	0.791	80%	0.803	S	S	*	*			trans	73.3	151.3	153.5	-78.6	176.9	179.7	-177.7	0	122.4
557	N	31.6	Very low	36.9	Very low	152 Å²	152	141 Å²	141	81%	0.813	80%	0.802	S	S	*	*			trans	77.4	143.9	152.1	-65	-7.5	0	0	0	119.2
558	A	30.3	Very low	37.6	Very low	87 Å²	87	138.2 Å²	138.2	72%	0.719	79%	0.794	S	S	*	*			cis	-160.8	148.2	-11.7	0	0	0	0	0	115.2
559	A	33.2	Very low	38.5	Very low	100 Å²	100	142.9 Å²	142.9	83%	0.826	80%	0.796	S	S	*	*			trans	32.9	137.3	140.5	0	0	0	0	0	124.8
560	V	30.3	Very low	40	Very low	145 Å²	145	145.5 Å²	145.5	88%	0.879	79%	0.793	S	S	*	*			trans	-135.1	149	157.4	174.3	0	0	0	0	108.7
561	P	45.6	Very low	41.3	Very low	112 Å²	112	143 Å²	143	73%	0.727	79%	0.788	S	S	*	*			trans	-121.6	151.4	-158.4	40.3	-28	0	0	0	117.8
562	T	30.7	Very low	42.3	Very low	140 Å²	140	139.3 Å²	139.3	86%	0.859	77%	0.772	S	S	*	*			trans	-148.8	176.8	161.3	2.5	0	0	0	0	111.1
563	P	40.3	Very low	43.3	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	76%	0.761	S	S	*	*	P	Polyproline II helix		-83.1	164.5	-127.7	36.7	-39.5	0	0	0	116
564	R	39.5	Very low	44.4	Very low	248 Å²	248	131.8 Å²	131.8	94%	0.936	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-102.6	124.1	175.7	-68.6	177.3	176.1	152.8	-2.3	112.2
565	T	39.7	Very low	46	Very low	127 Å²	127	125.9 Å²	125.9	78%	0.779	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-94.8	143.8	145.1	29	0	0	0	0	109.4	T567	T565-T567 PolarHBondContact O-N 2.71Å
566	P	41.6	Very low	47.7	Very low	129 Å²	129	126.5 Å²	126.5	84%	0.838	71%	0.714	S	S	*	*			trans	-90.1	85.3	-171	34.6	-35.2	0	0	0	113.2
567	T	55.2	Low	49	Very low	104 Å²	104	124.1 Å²	124.1	64%	0.638	71%	0.705	S	S	*	*			trans	-77.9	136.4	167.7	38.4	0	0	0	0	111.8	T565 F569	T565-T567 PolarHBondContact O-N 2.71Å; T567-F569 VanDerWaalsContact C-N 3.34Å; T567-F569 PolarHBondContact O-N 3.2Å
568	P	46.4	Very low	50.8	Low	106 Å²	106	125.7 Å²	125.7	69%	0.688	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-29.2	-170	25.3	-34.4	0	0	0	113.9	K570 K571	P568-K570 PolarHBondContact O-N 3Å; P568-K570 VanDerWaalsContact O-N 3.07Å; P568-K571 PolarHBondContact O-N 3.3Å
569	F	50	Low	52	Low	159 Å²	159	128.5 Å²	128.5	70%	0.697	71%	0.705	S	S	*	*	H	α-helix	trans	-52.4	-33	-177.7	-106.5	-94.9	0	0	0	114.4	T567 K571 A572 L573	T567-F569 VanDerWaalsContact C-N 3.34Å; T567-F569 PolarHBondContact O-N 3.2Å; F569-K571 VanDerWaalsContact C-N 3.25Å; F569-K571 PolarHBondContact O-N 2.72Å; F569-A572 WeakPolarHBondContact O-CB 3.32Å; F569-A572 PolarHBondContact O-N 2.96Å; F569-L573 PolarHBondContact O-N 2.91Å; F569-L573 VanDerWaalsContact O-N 3.11Å
570	K	59.8	Low	53.7	Low	173 Å²	173	130.5 Å²	130.5	75%	0.752	70%	0.697	S	S	*	*	H	α-helix	trans	-70.4	-19.8	-178	-163.5	154.3	-171.4	155.9	0	113.5	P568 A574	P568-K570 PolarHBondContact O-N 3Å; P568-K570 VanDerWaalsContact O-N 3.07Å; K570-A574 WeakPolarHBondContact O-CB 3.48Å
571	K	61.2	Low	55.3	Low	180 Å²	180	125 Å²	125	78%	0.783	67%	0.67	S	S	*	*	H	α-helix	trans	-78.5	-35.5	167.7	-77.6	-172.7	174.3	-177.5	0	112.2	P568 F569 A575	P568-K571 PolarHBondContact O-N 3.3Å; F569-K571 VanDerWaalsContact C-N 3.25Å; F569-K571 PolarHBondContact O-N 2.72Å; K571-A575 WeakPolarHBondContact O-CB 3.5Å; K571-A575 PolarHBondContact O-N 3.38Å
572	A	59.4	Low	55.6	Low	56 Å²	56	125.2 Å²	125.2	46%	0.463	67%	0.671	S	S	.	*	H	α-helix	trans	-65.8	-50.4	179.9	0	0	0	0	0	111.8	F569 A574 A575 Q576	F569-A572 WeakPolarHBondContact O-CB 3.32Å; F569-A572 PolarHBondContact O-N 2.96Å; A572-A574 PolarHBondContact O-N 2.96Å; A572-A575 WeakPolarHBondContact O-CB 3.41Å; A572-A575 PolarHBondContact O-N 3.39Å; A572-A575 VanDerWaalsContact O-N 3.1Å; A572-Q576 PolarHBondContact O-N 3.38Å
573	L	64.8	Low	56.2	Low	105 Å²	105	126 Å²	126	55%	0.55	67%	0.669	S	S	.	*	H	α-helix	trans	-61.7	-41.9	177.6	-70	171.3	0	0	0	112.3	F569 A575 Q576 E577	F569-L573 PolarHBondContact O-N 2.91Å; F569-L573 VanDerWaalsContact O-N 3.11Å; L573-A575 VanDerWaalsContact C-N 3.28Å; L573-A575 PolarHBondContact O-N 3.26Å; L573-Q576 PolarHBondContact O-N 3.14Å; L573-E577 WeakPolarHBondContact O-CB 3.32Å; L573-E577 PolarHBondContact O-N 3.04Å
574	A	65.4	Low	56.3	Low	55 Å²	55	131.4 Å²	131.4	46%	0.455	67%	0.674	S	S	.	*	H	α-helix	trans	-67.1	-26	175.8	0	0	0	0	0	113.4	K570 A572 K578	K570-A574 WeakPolarHBondContact O-CB 3.48Å; A572-A574 PolarHBondContact O-N 2.96Å; A574-K578 VanDerWaalsContact O-CB 3.3Å; A574-K578 WeakPolarHBondContact O-CB 3.39Å; A574-K578 PolarHBondContact O-N 3.04Å
575	A	65.9	Low	56.3	Low	52 Å²	52	128.1 Å²	128.1	43%	0.43	67%	0.671	S	S	.	*	H	α-helix	trans	-75.3	-42.9	171.4	0	0	0	0	0	111.4	K571 A572 L573 K578 M579	K571-A575 WeakPolarHBondContact O-CB 3.5Å; K571-A575 PolarHBondContact O-N 3.38Å; A572-A575 WeakPolarHBondContact O-CB 3.41Å; A572-A575 PolarHBondContact O-N 3.39Å; A572-A575 VanDerWaalsContact O-N 3.1Å; L573-A575 VanDerWaalsContact C-N 3.28Å; L573-A575 PolarHBondContact O-N 3.26Å; A575-K578 WeakPolarHBondContact O-CB 3.21Å; A575-K578 PolarHBondContact O-N 2.91Å; A575-M579 VanDerWaalsContact O-CG 3.3Å; A575-M579 WeakPolarHBondContact O-CG 3.49Å; A575-M579 PolarHBondContact O-N 2.97Å
576	Q	67.3	Low	56	Low	122 Å²	122	130.5 Å²	130.5	57%	0.57	67%	0.674	S	S	*	*	H	α-helix	trans	-63	-44.5	177.6	-171.6	176.4	-10.3	0	0	112	A572 L573 K578 M579 H580	A572-Q576 PolarHBondContact O-N 3.38Å; L573-Q576 PolarHBondContact O-N 3.14Å; Q576-K578 VanDerWaalsContact C-N 3.29Å; Q576-K578 PolarHBondContact O-N 3.48Å; Q576-M579 PolarHBondContact O-N 3.44Å; Q576-M579 VanDerWaalsContact O-N 3.14Å; Q576-H580 PolarHBondContact O-CD2 2.72Å; Q576-H580 PolarHBondContact O-N 3.22Å
577	E	70.4	Confident	56.1	Low	131 Å²	131	130.2 Å²	130.2	61%	0.612	67%	0.672	S	S	*	*	H	α-helix	trans	-61.7	-36.9	173.9	-171.5	176.7	-160.3	0	0	111.8	L573 M579 G581	L573-E577 WeakPolarHBondContact O-CB 3.32Å; L573-E577 PolarHBondContact O-N 3.04Å; E577-M579 VanDerWaalsContact C-N 3.35Å; E577-G581 WeakPolarHBondContact O-CA 3.42Å; E577-G581 PolarHBondContact O-N 2.94Å
578	K	69.1	Low	55.1	Low	185 Å²	185	134.1 Å²	134.1	80%	0.804	68%	0.683	S	S	*	*	H	α-helix	trans	-70.3	-26.3	175	-171.9	-178.1	177.7	-169	0	113.5	A574 A575 Q576	A574-K578 VanDerWaalsContact O-CB 3.3Å; A574-K578 WeakPolarHBondContact O-CB 3.39Å; A574-K578 PolarHBondContact O-N 3.04Å; A575-K578 WeakPolarHBondContact O-CB 3.21Å; A575-K578 PolarHBondContact O-N 2.91Å; Q576-K578 VanDerWaalsContact C-N 3.29Å; Q576-K578 PolarHBondContact O-N 3.48Å
579	M	56.8	Low	54.9	Low	146 Å²	146	134.4 Å²	134.4	72%	0.719	69%	0.685	S	S	*	*	H	α-helix	trans	-88.7	-31.7	-179.6	-70.9	-62.9	-65.1	0	0	113.6	A575 Q576 E577	A575-M579 VanDerWaalsContact O-CG 3.3Å; A575-M579 WeakPolarHBondContact O-CG 3.49Å; A575-M579 PolarHBondContact O-N 2.97Å; Q576-M579 PolarHBondContact O-N 3.44Å; Q576-M579 VanDerWaalsContact O-N 3.14Å; E577-M579 VanDerWaalsContact C-N 3.35Å
580	H	67.6	Low	55	Low	142 Å²	142	135.2 Å²	135.2	66%	0.657	70%	0.695	S	S	*	*	H	α-helix	trans	-120.7	-12.1	-171.7	-59.2	-71.8	0	0	0	114.9	Q576	Q576-H580 PolarHBondContact O-CD2 2.72Å; Q576-H580 PolarHBondContact O-N 3.22Å
581	G	65.7	Low	54.4	Low	31 Å²	31	130.3 Å²	130.3	32%	0.32	69%	0.687	S	S	.	*			trans	71	-179.8	179	0	0	0	0	0	114.7	E577 L583	E577-G581 WeakPolarHBondContact O-CA 3.42Å; E577-G581 PolarHBondContact O-N 2.94Å; G581-L583 PolarHBondContact O-N 3.34Å; G581-L583 VanDerWaalsContact O-N 3.14Å
582	P	51.3	Low	53.8	Low	115 Å²	115	128.4 Å²	128.4	75%	0.747	68%	0.679	S	S	*	*			trans	-75.3	103.9	-177.6	-15.3	31.5	0	0	0	111.2	R584	P582-R584 PolarHBondContact O-N 3.3Å
583	L	42.9	Very low	53.7	Low	156 Å²	156	130.9 Å²	130.9	82%	0.817	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-58	126.3	176.6	-64.8	174.3	0	0	0	110.9	G581	G581-L583 PolarHBondContact O-N 3.34Å; G581-L583 VanDerWaalsContact O-N 3.14Å
584	R	41.3	Very low	53.3	Low	238 Å²	238	133.4 Å²	133.4	90%	0.898	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-102	131.1	165.2	-57.5	-166.4	72.8	171.1	-0.4	108	P582	P582-R584 PolarHBondContact O-N 3.3Å
585	M	39.6	Very low	53.1	Low	178 Å²	178	136.3 Å²	136.3	88%	0.877	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-100.4	133.3	169.8	-69.5	-96.1	56	0	0	108.9
586	E	35.4	Very low	52.9	Low	178 Å²	178	137.8 Å²	137.8	83%	0.832	70%	0.697	S	S	*	*			trans	-119.8	126.9	-179.4	-173.8	161.7	-173.5	0	0	108
587	P	42.3	Very low	52.9	Low	123 Å²	123	136.3 Å²	136.3	80%	0.799	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-84	123.8	-172	31.6	-33.1	0	0	0	111.6
588	Q	34.1	Very low	52.5	Low	186 Å²	186	135.8 Å²	135.8	87%	0.869	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-92.5	157.3	164.4	-79.2	-163.7	-10.7	0	0	112.1
589	P	42.8	Very low	52.7	Low	112 Å²	112	132.5 Å²	132.5	73%	0.727	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-82.6	162.8	-173.6	-10.2	29.5	0	0	0	114.1	A591	P589-A591 PolarHBondContact O-N 2.84Å
590	L	51.8	Low	53.2	Low	176 Å²	176	129.7 Å²	129.7	92%	0.921	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	63.5	179	-63.6	164.6	0	0	0	112.7
591	A	46.3	Very low	53.1	Low	70 Å²	70	127 Å²	127	58%	0.579	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-27.7	-180	0	0	0	0	0	114.2	P589	P589-A591 PolarHBondContact O-N 2.84Å
592	F	50.1	Low	53.1	Low	140 Å²	140	131.5 Å²	131.5	61%	0.614	67%	0.672	S	S	*	*	S	Bend	trans	-85.2	-17.3	-172	-124.2	-97.5	0	0	0	114.7	E594 E595 D596	F592-E594 VanDerWaalsContact C-N 3.34Å; F592-E594 PolarHBondContact O-N 2.99Å; F592-E595 PolarHBondContact O-N 3.02Å; F592-D596 PolarHBondContact O-N 2.67Å; F592-D596 VanDerWaalsContact O-N 3.09Å
593	L	57.4	Low	53.4	Low	108 Å²	108	132.8 Å²	132.8	57%	0.565	67%	0.668	S	S	*	*	H	α-helix	trans	-68.9	-30.9	-169.6	-162.4	73.6	0	0	0	113.1	E595 I597	L593-E595 VanDerWaalsContact C-N 3.32Å; L593-I597 HydrophobicContact CD2-CD1 4.48Å; L593-I597 HydrophobicContact CG-CD1 4.08Å; L593-I597 WeakPolarHBondContact O-CB 3.45Å; L593-I597 WeakPolarHBondContact O-CD1 3.38Å; L593-I597 WeakPolarHBondContact O-CG1 3.24Å; L593-I597 PolarHBondContact O-N 2.9Å; L593-I597 VanDerWaalsContact O-N 3.08Å
594	E	56.2	Low	54.2	Low	157 Å²	157	132.7 Å²	132.7	73%	0.734	66%	0.664	S	S	*	*	H	α-helix	trans	-71.9	-30	177.2	-62.3	-173.7	157	0	0	111.6	F592 L598	F592-E594 VanDerWaalsContact C-N 3.34Å; F592-E594 PolarHBondContact O-N 2.99Å; E594-L598 VanDerWaalsContact O-CG 3.29Å; E594-L598 WeakPolarHBondContact O-CG 3.1Å; E594-L598 PolarHBondContact O-N 3.09Å
595	E	59.9	Low	55	Low	117 Å²	117	125.6 Å²	125.6	55%	0.547	65%	0.647	S	S	.	*	H	α-helix	trans	-74.5	-46.4	176.5	-59.5	-178.6	150.2	0	0	110.4	F592 L593 I597 L598 E599	F592-E595 PolarHBondContact O-N 3.02Å; L593-E595 VanDerWaalsContact C-N 3.32Å; E595-I597 VanDerWaalsContact C-N 3.35Å; E595-I597 PolarHBondContact O-N 3.5Å; E595-L598 PolarHBondContact O-N 3.38Å; E595-E599 PolarHBondContact O-N 3.34Å
596	D	62.3	Low	55.6	Low	82 Å²	82	120.2 Å²	120.2	44%	0.439	64%	0.638	S	S	.	*	H	α-helix	trans	-56.4	-44.7	172.9	-75.3	-18.7	0	0	0	112.1	F592 L598 E599 V600	F592-D596 PolarHBondContact O-N 2.67Å; F592-D596 VanDerWaalsContact O-N 3.09Å; D596-L598 PolarHBondContact O-N 3.3Å; D596-E599 PolarHBondContact O-N 3.07Å; D596-V600 WeakPolarHBondContact O-CG2 3.49Å; D596-V600 PolarHBondContact O-N 3.32Å
597	I	68.2	Low	56.3	Low	92 Å²	92	122.2 Å²	122.2	47%	0.472	64%	0.637	S	S	.	*	H	α-helix	trans	-64.4	-40.5	179.9	-73.1	166.3	0	0	0	111.4	L593 E595 L601	L593-I597 HydrophobicContact CD2-CD1 4.48Å; L593-I597 HydrophobicContact CG-CD1 4.08Å; L593-I597 WeakPolarHBondContact O-CB 3.45Å; L593-I597 WeakPolarHBondContact O-CD1 3.38Å; L593-I597 WeakPolarHBondContact O-CG1 3.24Å; L593-I597 PolarHBondContact O-N 2.9Å; L593-I597 VanDerWaalsContact O-N 3.08Å; E595-I597 VanDerWaalsContact C-N 3.35Å; E595-I597 PolarHBondContact O-N 3.5Å; I597-L601 HydrophobicContact CG2-CD1 4.11Å; I597-L601 WeakPolarHBondContact O-CG 3.23Å; I597-L601 PolarHBondContact O-N 2.97Å; I597-L601 VanDerWaalsContact O-N 3.11Å
598	L	61.9	Low	56.3	Low	120 Å²	120	122.2 Å²	122.2	63%	0.628	63%	0.631	S	S	*	*	H	α-helix	trans	-69.3	-35.1	176.5	-73.6	170.7	0	0	0	112.1	E594 E595 D596 K602	E594-L598 VanDerWaalsContact O-CG 3.29Å; E594-L598 WeakPolarHBondContact O-CG 3.1Å; E594-L598 PolarHBondContact O-N 3.09Å; E595-L598 PolarHBondContact O-N 3.38Å; D596-L598 PolarHBondContact O-N 3.3Å; L598-K602 WeakPolarHBondContact O-CB 3.43Å; L598-K602 PolarHBondContact O-N 3.05Å; L598-K602 VanDerWaalsContact O-N 3.07Å
599	E	72.1	Confident	56.7	Low	116 Å²	116	120.5 Å²	120.5	54%	0.542	63%	0.626	S	S	.	*	H	α-helix	trans	-68.1	-43.3	174.8	-173.5	166.1	165.6	0	0	111.9	E595 D596 L601 K602 Q603	E595-E599 PolarHBondContact O-N 3.34Å; D596-E599 PolarHBondContact O-N 3.07Å; E599-L601 PolarHBondContact O-N 3.32Å; E599-K602 WeakPolarHBondContact O-CB 3.39Å; E599-K602 PolarHBondContact O-N 3.28Å; E599-Q603 HydrophobicContact CG-CG 4.4Å; E599-Q603 WeakPolarHBondContact O-CG 3.44Å; E599-Q603 PolarHBondContact O-N 2.99Å; E599-Q603 PolarHBondContact OE1-NE2 3.11Å
600	V	69	Low	56.4	Low	86 Å²	86	125.2 Å²	125.2	52%	0.521	63%	0.631	S	S	.	*	H	α-helix	trans	-58.4	-49	174.8	170.4	0	0	0	0	111.3	D596 K602 Q603 E604	D596-V600 WeakPolarHBondContact O-CG2 3.49Å; D596-V600 PolarHBondContact O-N 3.32Å; V600-K602 PolarHBondContact O-N 3.39Å; V600-Q603 PolarHBondContact O-N 2.99Å; V600-Q603 VanDerWaalsContact O-N 3.16Å; V600-E604 WeakPolarHBondContact O-CB 3.32Å; V600-E604 PolarHBondContact O-N 3.12Å
601	L	63.7	Low	55.7	Low	86 Å²	86	124.9 Å²	124.9	45%	0.45	63%	0.627	S	S	.	*	H	α-helix	trans	-60.2	-34.6	177.5	-75.7	167.2	0	0	0	112.7	I597 E599 T605	I597-L601 HydrophobicContact CG2-CD1 4.11Å; I597-L601 WeakPolarHBondContact O-CG 3.23Å; I597-L601 PolarHBondContact O-N 2.97Å; I597-L601 VanDerWaalsContact O-N 3.11Å; E599-L601 PolarHBondContact O-N 3.32Å; L601-T605 WeakPolarHBondContact O-CB 3.46Å; L601-T605 PolarHBondContact O-N 3.48Å; L601-T605 PolarHBondContact O-OG1 3.07Å
602	K	65.7	Low	54.9	Low	125 Å²	125	128.9 Å²	128.9	54%	0.543	64%	0.638	S	S	.	*	H	α-helix	trans	-70.5	-40.4	176	-178.1	169.2	177.4	133.7	0	112.3	L598 E599 V600 G606 D608	L598-K602 WeakPolarHBondContact O-CB 3.43Å; L598-K602 PolarHBondContact O-N 3.05Å; L598-K602 VanDerWaalsContact O-N 3.07Å; E599-K602 WeakPolarHBondContact O-CB 3.39Å; E599-K602 PolarHBondContact O-N 3.28Å; V600-K602 PolarHBondContact O-N 3.39Å; K602-G606 PolarHBondContact O-N 3.33Å; K602-D608 WeakPolarHBondContact CE-OD1 3.48Å; K602-D608 IonicContact NZ-OD1 3.79Å; K602-D608 PolarHBondContact NZ-OD1 3.44Å; K602-D608 IonicContact NZ-OD2 2.69Å
603	Q	58.5	Low	53.9	Low	142 Å²	142	125 Å²	125	66%	0.664	64%	0.638	S	S	*	*	H	α-helix	trans	-66.8	-35.8	175	-68.4	-178.4	21.3	0	0	111.9	E599 V600	E599-Q603 HydrophobicContact CG-CG 4.4Å; E599-Q603 WeakPolarHBondContact O-CG 3.44Å; E599-Q603 PolarHBondContact O-N 2.99Å; E599-Q603 PolarHBondContact OE1-NE2 3.11Å; V600-Q603 PolarHBondContact O-N 2.99Å; V600-Q603 VanDerWaalsContact O-N 3.16Å
604	E	58.8	Low	53.2	Low	155 Å²	155	126.1 Å²	126.1	72%	0.724	65%	0.652	S	S	*	*	H	α-helix	trans	-79.9	-35.3	-177.5	-168.3	168.2	-148.1	0	0	113.8	V600	V600-E604 WeakPolarHBondContact O-CB 3.32Å; V600-E604 PolarHBondContact O-N 3.12Å
605	T	58.9	Low	52.2	Low	88 Å²	88	123 Å²	123	54%	0.54	65%	0.652	S	S	.	*	H	α-helix	trans	-93.7	-23.4	-171.7	-44.8	0	0	0	0	114.2	L601 R607	L601-T605 WeakPolarHBondContact O-CB 3.46Å; L601-T605 PolarHBondContact O-N 3.48Å; L601-T605 PolarHBondContact O-OG1 3.07Å; T605-R607 PolarHBondContact O-N 3.29Å; T605-R607 VanDerWaalsContact O-N 3.09Å
606	G	52.2	Low	50.9	Low	66 Å²	66	129 Å²	129	68%	0.68	67%	0.67	S	S	*	*			trans	66.6	8.7	171.8	0	0	0	0	0	117.3	K602	K602-G606 PolarHBondContact O-N 3.33Å
607	R	49	Very low	49.4	Very low	219 Å²	219	134.9 Å²	134.9	83%	0.826	69%	0.692	S	S	*	*	S	Bend	trans	-144.7	134.4	172.3	-62.8	-174.6	-174.8	171	4.2	110.5	T605 I609	T605-R607 PolarHBondContact O-N 3.29Å; T605-R607 VanDerWaalsContact O-N 3.09Å; R607-I609 PolarHBondContact O-N 2.98Å
608	D	42.9	Very low	47.9	Very low	123 Å²	123	137.2 Å²	137.2	66%	0.658	71%	0.71	S	S	*	*			trans	-69.7	125.4	175.4	-68.4	-58.8	0	0	0	111	K602	K602-D608 WeakPolarHBondContact CE-OD1 3.48Å; K602-D608 IonicContact NZ-OD1 3.79Å; K602-D608 PolarHBondContact NZ-OD1 3.44Å; K602-D608 IonicContact NZ-OD2 2.69Å
609	I	43.5	Very low	46.4	Very low	150 Å²	150	143.1 Å²	143.1	77%	0.769	72%	0.724	S	S	*	*			trans	-105.7	95.3	170.1	-56.9	179.1	0	0	0	108.2	R607	R607-I609 PolarHBondContact O-N 2.98Å
610	Y	36.7	Very low	44.6	Very low	211 Å²	211	147 Å²	147	83%	0.827	74%	0.739	S	S	*	*			trans	-100	119.4	173.1	-142.3	-84.9	0	0	0	109.1
611	M	35.7	Very low	42.7	Very low	170 Å²	170	147.9 Å²	147.9	84%	0.837	75%	0.749	S	S	*	*			trans	-132.6	118.7	171.2	-73.4	-64.3	-73.8	0	0	109.3
612	D	30.5	Very low	41	Very low	153 Å²	153	151.1 Å²	151.1	82%	0.818	77%	0.766	S	S	*	*			trans	-80.4	165.3	-176.9	-161.3	-0.2	0	0	0	111.9
613	G	28.4	Very low	39.1	Very low	59 Å²	59	151 Å²	151	61%	0.608	78%	0.775	S	S	*	*			trans	-83.3	-157.1	-176.7	0	0	0	0	0	115
614	P	43.8	Very low	37.6	Very low	132 Å²	132	150.6 Å²	150.6	86%	0.857	78%	0.777	S	S	*	*			cis	-131.2	157.3	7.2	39.5	-22.8	0	0	0	117.3
615	A	34.9	Very low	36.2	Very low	90 Å²	90	149.7 Å²	149.7	74%	0.744	78%	0.777	S	S	*	*			trans	-38.7	152	178.5	0	0	0	0	0	120.6
616	R	31.6	Very low	35.7	Very low	245 Å²	245	150.2 Å²	150.2	93%	0.925	78%	0.782	S	S	*	*			trans	-159.7	104.2	141.3	-104.3	146.4	-158.5	-112.5	5.6	115.8
617	K	31.7	Very low	34.6	Very low	204 Å²	204	158.1 Å²	158.1	89%	0.887	79%	0.791	S	S	*	*			trans	26.8	118.5	143.9	-63.2	177	-179.8	176.3	0	120.5
618	V	37.2	Very low	33.6	Very low	142 Å²	142	152.4 Å²	152.4	86%	0.861	78%	0.781	S	S	*	*			trans	-56.5	140.3	165.1	175.9	0	0	0	0	113.9
619	R	30.1	Very low	32.8	Very low	243 Å²	243	154.4 Å²	154.4	92%	0.917	79%	0.786	S	S	*	*			trans	-141.4	155.5	147.5	-82.7	-163.2	169.2	169.8	-2.9	111.9
620	K	34.3	Very low	32	Very low	199 Å²	199	154.4 Å²	154.4	87%	0.865	79%	0.788	S	S	*	*			trans	-71.6	154.2	-177.4	-42.5	167	-177.8	179.7	0	111.7
621	S	28.8	Very low	31.5	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	78%	0.782	S	S	*	*				171.1	141.2	114.2	59.1	0	0	0	0	116.1
622	L	26.9	Very low	30.9	Very low	155 Å²	155	149.4 Å²	149.4	81%	0.812	79%	0.786	S	S	*	*			trans	64.8	125	137.1	-67.8	165.7	0	0	0	122.8
623	V	27.5	Very low	30.7	Very low	122 Å²	122	148.9 Å²	148.9	74%	0.739	78%	0.783	S	S	*	*			trans	88.3	152.4	130.4	171.5	0	0	0	0	120
624	L	26.3	Very low	30.6	Very low	133 Å²	133	151.9 Å²	151.9	70%	0.696	79%	0.789	S	S	*	*			trans	-70.4	-178	-178.6	-47.9	71.9	0	0	0	111.5
625	D	28.7	Very low	29.7	Very low	137 Å²	137	154.9 Å²	154.9	73%	0.733	79%	0.789	S	S	*	*			cis	-154.3	-167.3	21.9	-122.2	-21	0	0	0	110.4
626	P	49.3	Very low	29.2	Very low	98 Å²	98	159.8 Å²	159.8	64%	0.636	80%	0.796	S	S	*	*			trans	-105.7	-122.2	-153.1	43.2	-37.3	0	0	0	115.1
627	W	28.8	Very low	29	Very low	232 Å²	232	156.1 Å²	156.1	88%	0.879	79%	0.79	S	S	*	*			trans	76.1	138.5	-170.5	-55.4	79.5	0	0	0	113.7
628	V	27.1	Very low	28.8	Very low	100 Å²	100	155.2 Å²	155.2	61%	0.606	79%	0.789	S	S	*	*			cis	-157	133.8	-10.6	101.5	0	0	0	0	107.2
629	E	27	Very low	28.2	Very low	164 Å²	164	156.7 Å²	156.7	77%	0.766	79%	0.791	S	S	*	*				68.9	117.6	92.1	-177.9	178.6	-124.7	0	0	115.8
630	D	26.8	Very low	28	Very low	151 Å²	151	152 Å²	152	81%	0.807	78%	0.784	S	S	*	*			trans	178	140.6	146.7	-114.5	-18.1	0	0	0	108.4
631	S	25.5	Very low	27.8	Very low	102 Å²	102	150 Å²	150	71%	0.713	78%	0.783	S	S	*	*			cis	-155.9	140	-19.9	-142.1	0	0	0	0	107.7
632	L	24.2	Very low	27.7	Very low	173 Å²	173	148.6 Å²	148.6	91%	0.906	78%	0.778	S	S	*	*			trans	-152.4	89.7	177.7	-151.9	-172.9	0	0	0	110.4
633	D	26	Very low	27.8	Very low	142 Å²	142	149.2 Å²	149.2	76%	0.759	78%	0.776	S	S	*	*			trans	-150.9	130.5	173.9	-161.9	0.7	0	0	0	112.8
634	V	26.6	Very low	27.7	Very low	123 Å²	123	149.9 Å²	149.9	75%	0.745	77%	0.774	S	S	*	*			trans	-154.1	121	162.4	164.4	0	0	0	0	108
635	F	24.1	Very low	27.7	Very low	195 Å²	195	148.1 Å²	148.1	86%	0.855	77%	0.773	S	S	*	*			trans	64.9	94.2	173	-71.1	-59.1	0	0	0	118.4
636	Q	24.2	Very low	27.6	Very low	192 Å²	192	150.3 Å²	150.3	90%	0.897	78%	0.779	S	S	*	*				-157.3	106	108.8	-168.1	169.9	10.6	0	0	113.9
637	E	27.5	Very low	26.5	Very low	168 Å²	168	152.8 Å²	152.8	79%	0.785	78%	0.782	S	S	*	*			trans	-158.6	132.8	148.2	-144.2	-169.7	-175.7	0	0	113.5
638	Q	27	Very low	26.5	Very low	185 Å²	185	147.2 Å²	147.2	86%	0.864	77%	0.769	S	S	*	*				178.4	102.2	125.4	-101.3	-171	3.9	0	0	110.3
639	L	25.1	Very low	26.7	Very low	173 Å²	173	149.3 Å²	149.3	91%	0.906	78%	0.776	S	S	*	*			trans	-177.5	112.8	140.5	-107.3	171	0	0	0	109.5
640	N	27.1	Very low	26.6	Very low	145 Å²	145	149.3 Å²	149.3	78%	0.775	78%	0.778	S	S	*	*			trans	-151	132.8	163.7	-159.9	-4.8	0	0	0	109.4
641	N	28.2	Very low	26.6	Very low	156 Å²	156	145.4 Å²	145.4	83%	0.834	77%	0.767	S	S	*	*			trans	-165.5	128.7	166.6	-122.1	-21.8	0	0	0	112.5
642	A	28.1	Very low	26.7	Very low	74 Å²	74	148.1 Å²	148.1	61%	0.612	77%	0.774	S	S	*	*			trans	70.7	113.6	151.9	0	0	0	0	0	121.9
643	Q	28	Very low	26.8	Very low	168 Å²	168	144.8 Å²	144.8	79%	0.785	77%	0.765	S	S	*	*				97	111.7	126.9	-72.2	178.2	-74.6	0	0	123.7
644	I	26.6	Very low	26.6	Very low	136 Å²	136	142.6 Å²	142.6	70%	0.697	76%	0.761	S	S	*	*				94.7	142.3	121.4	-71	172.2	0	0	0	121.2
645	S	26.1	Very low	26.5	Very low	96 Å²	96	143.8 Å²	143.8	67%	0.671	76%	0.762	S	S	*	*			trans	65.6	131.3	173.6	42.6	0	0	0	0	116.4
646	E	25.4	Very low	26.7	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	75%	0.754	S	S	*	*				66.5	135.2	53.3	-63.3	-178.3	149.8	0	0	112.1
647	E	28	Very low	26.8	Very low	150 Å²	150	135.9 Å²	135.9	70%	0.701	74%	0.743	S	S	*	*			cis	-159.6	159.5	7.3	-139.6	-162.1	155.3	0	0	110.1
648	N	28.8	Very low	26.8	Very low	115 Å²	115	135.8 Å²	135.8	62%	0.615	74%	0.742	S	S	*	*			trans	58.6	169.3	148.9	-68.5	-18.1	0	0	0	121.3
649	L	29.8	Very low	26.8	Very low	144 Å²	144	136.2 Å²	136.2	75%	0.754	75%	0.745	S	S	*	*			cis	-153.1	158.3	-39.2	-110.4	170.1	0	0	0	111.4
650	M	26.5	Very low	26.9	Very low	164 Å²	164	135.5 Å²	135.5	81%	0.808	74%	0.742	S	S	*	*			trans	-20.4	126.7	167.5	-66.3	-80.8	-80.7	0	0	122.1
651	A	26.7	Very low	26.9	Very low	69 Å²	69	136 Å²	136	57%	0.57	74%	0.744	S	S	*	*				73.1	149.4	117.4	0	0	0	0	0	124.7
652	N	27.6	Very low	26.8	Very low	159 Å²	159	131.8 Å²	131.8	85%	0.85	74%	0.738	S	S	*	*			trans	73.1	160	156.8	-58.8	-25.2	0	0	0	119.6
653	S	25.4	Very low	26.7	Very low	104 Å²	104	139 Å²	139	73%	0.727	75%	0.75	S	S	*	*			cis	-173.1	133.7	-36.8	-169	0	0	0	0	111.8
654	S	22.7	Very low	26.6	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	75%	0.747	S	S	*	*			trans	60	144.9	147.4	-145.3	0	0	0	0	124.8
655	L	24.8	Very low	27.2	Very low	149 Å²	149	137.2 Å²	137.2	78%	0.78	75%	0.748	S	S	*	*			trans	69.7	152.5	151.8	-110.6	63.5	0	0	0	120.3
656	V	27.1	Very low	27.2	Very low	113 Å²	113	136.8 Å²	136.8	69%	0.685	75%	0.75	S	S	*	*			cis	-116.2	-119.6	-2.4	-156.6	0	0	0	0	111.7
657	T	27	Very low	27.1	Very low	108 Å²	108	136.8 Å²	136.8	66%	0.663	75%	0.747	S	S	*	*			cis	-166.1	134.8	-1.6	-12.4	0	0	0	0	109.7
658	E	27.3	Very low	27	Very low	165 Å²	165	135.8 Å²	135.8	77%	0.771	74%	0.743	S	S	*	*			trans	42.5	161.7	159.4	-34.2	-56.3	80.1	0	0	122.1
659	E	26.1	Very low	26.8	Very low	195 Å²	195	137.5 Å²	137.5	91%	0.911	75%	0.745	S	S	*	*			cis	-128.5	-176.8	0.6	-77.5	-173.2	131.3	0	0	111.5
660	D	27.3	Very low	26.6	Very low	158 Å²	158	135.7 Å²	135.7	85%	0.845	74%	0.736	S	S	*	*			trans	-126.5	-179.1	-160.5	-172.3	31	0	0	0	115.7
661	D	27.6	Very low	26.7	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	73%	0.731	S	S	*	*			trans	98.6	152.1	148.9	-151.5	7.6	0	0	0	120.2
662	G	26.7	Very low	26.5	Very low	69 Å²	69	137.5 Å²	137.5	71%	0.711	74%	0.74	S	S	*	*			trans	118.3	107.6	168.9	0	0	0	0	0	116.2
663	R	25.9	Very low	26.4	Very low	226 Å²	226	134.2 Å²	134.2	85%	0.853	73%	0.729	S	S	*	*			trans	-147	126.1	-169.5	178.8	178.7	-110.5	-90	0.8	116.8
664	Q	25.6	Very low	26.3	Very low	156 Å²	156	137.3 Å²	137.3	73%	0.729	74%	0.737	S	S	*	*			trans	67.5	178.9	156.8	-67.7	-79.2	-49.3	0	0	115.9
665	P	39.5	Very low	26.4	Very low	110 Å²	110	136.2 Å²	136.2	71%	0.714	74%	0.74	S	S	*	*			cis	-140.9	172.9	5.3	44.5	-26.9	0	0	0	119.5
666	A	24.6	Very low	26.4	Very low	87 Å²	87	135.4 Å²	135.4	72%	0.719	74%	0.741	S	S	*	*			trans	63.8	179.8	141	0	0	0	0	0	122.7
667	F	23.5	Very low	26.2	Very low	182 Å²	182	136.1 Å²	136.1	80%	0.798	75%	0.751	S	S	*	*				-173.6	-174.7	-64	-140.9	-97.8	0	0	0	109.8
668	E	25.8	Very low	26	Very low	130 Å²	130	133.7 Å²	133.7	61%	0.607	75%	0.747	S	S	*	*			trans	77.8	126.5	171	-57.9	-72.2	93.6	0	0	115.8
669	K	25.8	Very low	26.1	Very low	151 Å²	151	134.1 Å²	134.1	66%	0.657	75%	0.749	S	S	*	*				87.2	153.1	56.2	-77.3	-164.8	-153.2	129.9	0	113.1
670	D	25.4	Very low	26	Very low	105 Å²	105	130 Å²	130	56%	0.561	74%	0.737	S	S	*	*			cis	-163.5	176.5	9	-140	-22.3	0	0	0	114.3
671	K	27.6	Very low	25.9	Very low	164 Å²	164	130.6 Å²	130.6	71%	0.713	74%	0.735	S	S	*	*			trans	65.5	128.8	151.6	-68.2	161.9	-174.7	91.6	0	119.4
672	S	24.4	Very low	25.7	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	73%	0.731	S	S	*	*				97.5	156	64.6	101	0	0	0	0	112.5
673	S	24.4	Very low	25.6	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	73%	0.733	S	S	*	*			cis	-166.2	175.2	1.6	55.3	0	0	0	0	113
674	L	24.3	Very low	25.6	Very low	169 Å²	169	127.6 Å²	127.6	89%	0.885	73%	0.727	S	S	*	*			trans	75.9	146.8	151.6	-77.4	161.4	0	0	0	123.2
675	G	24.4	Very low	25.8	Very low	71 Å²	71	128.9 Å²	128.9	73%	0.732	73%	0.725	S	S	*	*			trans	106.5	136.1	164.2	0	0	0	0	0	116.6
676	V	23.9	Very low	25.3	Very low	132 Å²	132	129.5 Å²	129.5	80%	0.8	73%	0.729	S	S	*	*			cis	162.5	125.6	-39.1	154.3	0	0	0	0	107.1
677	S	23.4	Very low	25.4	Very low	129 Å²	129	131.8 Å²	131.8	90%	0.902	73%	0.725	S	S	*	*			trans	64.7	159.4	172.1	-134.5	0	0	0	0	116.6
678	G	23.6	Very low	25.6	Very low	56 Å²	56	126.7 Å²	126.7	58%	0.577	72%	0.716	S	S	*	*			cis	179.3	-172.3	-1.1	0	0	0	0	0	112.2
679	H	28.2	Very low	25.9	Very low	174 Å²	174	130.3 Å²	130.3	81%	0.806	73%	0.73	S	S	*	*			trans	63.6	102.9	177.1	-70.1	-68.1	0	0	0	117.1
680	T	24.2	Very low	26.1	Very low	109 Å²	109	130.9 Å²	130.9	67%	0.669	74%	0.74	S	S	*	*				73.2	118.2	66.9	67.1	0	0	0	0	116.1
681	H	25.4	Very low	26.1	Very low	171 Å²	171	129.3 Å²	129.3	79%	0.792	75%	0.749	S	S	*	*				-137.2	140.8	120.3	-112.7	-78.5	0	0	0	109.9	F683	H681-F683 AromaticContact CE1-CE2 3.88Å; H681-F683 AromaticContact ND1-CE2 3.45Å; H681-F683 WeakPolarHBondContact ND1-CE2 3.36Å
682	C	23.2	Very low	26.8	Very low	110 Å²	110	127.5 Å²	127.5	74%	0.743	75%	0.754	S	S	*	*			trans	-137.7	123.4	-178.9	-176.6	0	0	0	0	109.2
683	F	25.1	Very low	26.9	Very low	173 Å²	173	128 Å²	128	76%	0.759	76%	0.758	S	S	*	*			trans	-156.3	142.3	168.6	-65.9	-69.1	0	0	0	107.7	H681	H681-F683 AromaticContact CE1-CE2 3.88Å; H681-F683 AromaticContact ND1-CE2 3.45Å; H681-F683 WeakPolarHBondContact ND1-CE2 3.36Å
684	S	25.5	Very low	27.1	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	76%	0.762	S	S	*	*			cis	-156.4	144.9	-23.9	-101.5	0	0	0	0	108.5
685	R	29.5	Very low	27.5	Very low	183 Å²	183	129.3 Å²	129.3	69%	0.691	76%	0.76	S	S	*	*			trans	-83.1	142.5	168.1	-177.4	-174.8	179.7	-144.6	-1	109.6	E687	R685-E687 IonicContact CZ-OE1 3.72Å; R685-E687 IonicContact CZ-OE2 3.56Å; R685-E687 IonicContact NH1-OE1 2.93Å; R685-E687 PolarHBondContact NH1-OE1 3.35Å; R685-E687 IonicContact NH1-OE2 3.13Å; R685-E687 PolarHBondContact NH1-OE2 3.39Å; R685-E687 IonicContact NH2-OE1 3.6Å; R685-E687 PolarHBondContact NH2-OE1 2.97Å; R685-E687 IonicContact NH2-OE2 2.69Å
686	P	29.6	Very low	27.8	Very low	123 Å²	123	136 Å²	136	80%	0.799	77%	0.769	S	S	*	*			trans	-101	108.6	151	-12.6	30.9	0	0	0	111.7
687	E	25.9	Very low	28.1	Very low	135 Å²	135	138.4 Å²	138.4	63%	0.631	77%	0.772	S	S	*	*			trans	-75.6	161	142.2	-118.5	160.3	-171.2	0	0	107.6	R685	R685-E687 IonicContact CZ-OE1 3.72Å; R685-E687 IonicContact CZ-OE2 3.56Å; R685-E687 IonicContact NH1-OE1 2.93Å; R685-E687 PolarHBondContact NH1-OE1 3.35Å; R685-E687 IonicContact NH1-OE2 3.13Å; R685-E687 PolarHBondContact NH1-OE2 3.39Å; R685-E687 IonicContact NH2-OE1 3.6Å; R685-E687 PolarHBondContact NH2-OE1 2.97Å; R685-E687 IonicContact NH2-OE2 2.69Å
688	A	29.3	Very low	29	Very low	75 Å²	75	137.1 Å²	137.1	62%	0.62	76%	0.76	S	S	*	*			cis	-158.3	177.1	0.2	0	0	0	0	0	108.1
689	K	31.8	Very low	29.3	Very low	206 Å²	206	144.2 Å²	144.2	90%	0.896	78%	0.775	S	S	*	*				-175.3	140	123.7	-99.6	155.1	-173.5	177.8	0	113.2
690	N	28.4	Very low	29.8	Very low	163 Å²	163	141.7 Å²	141.7	87%	0.872	78%	0.777	S	S	*	*			trans	-69.4	146.1	176	-45.2	-44	0	0	0	109.4
691	G	26.4	Very low	30.2	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	78%	0.78	S	S	*	*				105.2	176.5	66.8	0	0	0	0	0	109.4
692	P	42.6	Very low	30.8	Very low	126 Å²	126	139.4 Å²	139.4	82%	0.818	78%	0.782	S	S	*	*			cis	-134.8	179.6	-11.2	43.2	-27.7	0	0	0	114.8
693	S	26.1	Very low	31.4	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	78%	0.781	S	S	*	*			trans	66.5	153	158.7	-135.5	0	0	0	0	117.9
694	S	28.9	Very low	32.5	Very low	103 Å²	103	139.6 Å²	139.6	72%	0.72	79%	0.789	S	S	*	*			cis	-152.6	167.2	17.6	61.7	0	0	0	0	113.5
695	H	33.3	Very low	33.7	Very low	183 Å²	183	138.6 Å²	138.6	85%	0.847	78%	0.779	S	S	*	*			trans	-62.3	145	174.4	-67.2	-101.4	0	0	0	114.7
696	K	30.5	Very low	35.2	Very low	210 Å²	210	133 Å²	133	91%	0.913	77%	0.768	S	S	*	*			trans	-170.7	110.3	140.2	-107.7	162	-174	175.1	0	113.2
697	E	29.5	Very low	36.5	Very low	184 Å²	184	133.5 Å²	133.5	86%	0.86	76%	0.764	S	S	*	*			trans	-82	173.4	141.8	-85.8	-165.4	127.1	0	0	109.2
698	P	43	Very low	37.8	Very low	101 Å²	101	136.6 Å²	136.6	66%	0.656	77%	0.77	S	S	*	*			cis	-126.3	166.5	-5.7	37.7	-23.9	0	0	0	114
699	K	28.7	Very low	39.6	Very low	205 Å²	205	137.4 Å²	137.4	89%	0.891	76%	0.761	S	S	*	*				175.9	149.2	121.7	-97.3	165.6	-176.6	-179.5	0	112
700	S	39.9	Very low	41.4	Very low	122 Å²	122	128.7 Å²	128.7	85%	0.853	73%	0.727	S	S	*	*			trans	-84.6	138.9	178.5	46.3	0	0	0	0	112.8
701	S	30.9	Very low	43.5	Very low	104 Å²	104	124.1 Å²	124.1	73%	0.727	71%	0.705	S	S	*	*			trans	-126.4	153.9	158	57.5	0	0	0	0	108.7
702	P	38.9	Very low	45.6	Very low	127 Å²	127	126 Å²	126	83%	0.825	70%	0.702	S	S	*	*			trans	-60.8	142.6	171.5	-18.6	32	0	0	0	110.2
703	A	36.9	Very low	46.8	Very low	89 Å²	89	127.4 Å²	127.4	74%	0.736	69%	0.692	S	S	*	*			trans	-65.9	138.4	173.3	0	0	0	0	0	110.2	V705	A703-V705 PolarHBondContact O-N 3.1Å; A703-V705 VanDerWaalsContact O-N 3.09Å
704	Q	47.1	Very low	49	Very low	198 Å²	198	123.3 Å²	123.3	93%	0.925	67%	0.668	S	S	*	*			trans	-65.2	108.5	160.7	-73.1	-176.7	-76.4	0	0	107.7
705	V	50.1	Low	51.1	Low	82 Å²	82	124.9 Å²	124.9	50%	0.497	66%	0.662	S	S	.	*			trans	-62.9	131.6	165.6	179	0	0	0	0	106.9	A703 E709	A703-V705 PolarHBondContact O-N 3.1Å; A703-V705 VanDerWaalsContact O-N 3.09Å; V705-E709 HydrophobicContact CG1-CB 3.92Å; V705-E709 HydrophobicContact CG1-CG 4.1Å
706	S	61.2	Low	53.6	Low	66 Å²	66	118 Å²	118	46%	0.462	63%	0.633	S	S	.	*			trans	-69	141.5	178.7	-170.2	0	0	0	0	109.8	W708 E709 A710	S706-W708 PolarHBondContact O-N 2.99Å; S706-W708 VanDerWaalsContact O-N 3.08Å; S706-E709 WeakPolarHBondContact O-CA 3.28Å; S706-E709 VanDerWaalsContact O-CB 3.26Å; S706-E709 WeakPolarHBondContact O-CB 3.42Å; S706-E709 PolarHBondContact O-N 3.38Å; S706-A710 PolarHBondContact O-N 3.42Å
707	D	56.7	Low	55.7	Low	132 Å²	132	115 Å²	115	71%	0.706	62%	0.622	S	S	*	*	H	α-helix	trans	-55.7	-35.8	-174.4	-51.3	-59	0	0	0	112.5	E709 A710 V711	D707-E709 VanDerWaalsContact C-N 3.31Å; D707-E709 PolarHBondContact O-N 2.93Å; D707-A710 WeakPolarHBondContact O-CB 3.32Å; D707-A710 PolarHBondContact O-N 3.3Å; D707-V711 WeakPolarHBondContact O-CG2 3.38Å; D707-V711 PolarHBondContact O-N 2.92Å; D707-V711 VanDerWaalsContact O-N 3.09Å
708	W	54.4	Low	58	Low	200 Å²	200	112 Å²	112	76%	0.758	61%	0.612	S	S	*	*	H	α-helix	trans	-63.8	-32.8	174.3	-65.9	98.8	0	0	0	113.7	S706 V711 V712	S706-W708 PolarHBondContact O-N 2.99Å; S706-W708 VanDerWaalsContact O-N 3.08Å; W708-V711 PolarHBondContact O-N 3.17Å; W708-V712 VanDerWaalsContact O-CG2 3.3Å; W708-V712 WeakPolarHBondContact O-CG2 3.47Å; W708-V712 PolarHBondContact O-N 3.32Å
709	E	66.9	Low	59.6	Low	93 Å²	93	110.4 Å²	110.4	44%	0.435	60%	0.596	S	S	.	*	H	α-helix	trans	-74.2	-33.3	177.4	-169	170.8	-147.1	0	0	110.9	V705 S706 D707 V712 Y713	V705-E709 HydrophobicContact CG1-CB 3.92Å; V705-E709 HydrophobicContact CG1-CG 4.1Å; S706-E709 WeakPolarHBondContact O-CA 3.28Å; S706-E709 VanDerWaalsContact O-CB 3.26Å; S706-E709 WeakPolarHBondContact O-CB 3.42Å; S706-E709 PolarHBondContact O-N 3.38Å; D707-E709 VanDerWaalsContact C-N 3.31Å; D707-E709 PolarHBondContact O-N 2.93Å; E709-V712 PolarHBondContact O-N 3.46Å; E709-Y713 HydrophobicContact CG-CD2 3.7Å; E709-Y713 HydrophobicContact CG-CE2 3.71Å; E709-Y713 VanDerWaalsContact O-CD2 3.28Å; E709-Y713 WeakPolarHBondContact O-CD2 3.49Å; E709-Y713 PolarHBondContact O-N 3.27Å; E709-Y713 VanDerWaalsContact O-N 3.09Å
710	A	68.5	Low	61.9	Low	22 Å²	22	105.3 Å²	105.3	18%	0.182	58%	0.578	C	S	.	*	H	α-helix	trans	-64.8	-42	169.4	0	0	0	0	0	112.1	S706 D707 G714 K715	S706-A710 PolarHBondContact O-N 3.42Å; D707-A710 WeakPolarHBondContact O-CB 3.32Å; D707-A710 PolarHBondContact O-N 3.3Å; A710-G714 PolarHBondContact O-N 3.23Å; A710-K715 HydrophobicContact CB-CB 4.32Å; A710-K715 PolarHBondContact O-N 3.3Å
711	V	72.8	Confident	63.5	Low	68 Å²	68	103.4 Å²	103.4	41%	0.412	56%	0.557	S	S	.	*	H	α-helix	trans	-62.4	-43.3	174.7	174.2	0	0	0	0	112.2	D707 W708 T716	D707-V711 WeakPolarHBondContact O-CG2 3.38Å; D707-V711 PolarHBondContact O-N 2.92Å; D707-V711 VanDerWaalsContact O-N 3.09Å; W708-V711 PolarHBondContact O-N 3.17Å; V711-T716 HydrophobicContact CB-CG2 4.37Å; V711-T716 HydrophobicContact CG2-CG2 3.63Å
712	V	71.4	Confident	65.3	Low	112 Å²	112	104.8 Å²	104.8	68%	0.679	55%	0.554	S	S	*	*	H	α-helix	trans	-70.4	-34.8	-178.2	167.4	0	0	0	0	112.5	W708 E709	W708-V712 VanDerWaalsContact O-CG2 3.3Å; W708-V712 WeakPolarHBondContact O-CG2 3.47Å; W708-V712 PolarHBondContact O-N 3.32Å; E709-V712 PolarHBondContact O-N 3.46Å
713	Y	67.8	Low	67.1	Low	155 Å²	155	101.7 Å²	101.7	61%	0.608	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	11.9	-179.2	-71.3	-61	0	0	0	115.1	E709	E709-Y713 HydrophobicContact CG-CD2 3.7Å; E709-Y713 HydrophobicContact CG-CE2 3.71Å; E709-Y713 VanDerWaalsContact O-CD2 3.28Å; E709-Y713 WeakPolarHBondContact O-CD2 3.49Å; E709-Y713 PolarHBondContact O-N 3.27Å; E709-Y713 VanDerWaalsContact O-N 3.09Å
714	G	70.9	Confident	68.8	Low	33 Å²	33	101.6 Å²	101.6	34%	0.34	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	26.7	175.3	0	0	0	0	0	114.4	A710 Q719	A710-G714 PolarHBondContact O-N 3.23Å; G714-Q719 VanDerWaalsContact CA-OE1 3.24Å
715	K	73.7	Confident	69.8	Low	137 Å²	137	97 Å²	97	60%	0.596	50%	0.496	S	S	*	.			trans	-110.3	8.1	-168.7	-63.5	177.9	-177.5	170.3	0	114.3	A710	A710-K715 HydrophobicContact CB-CB 4.32Å; A710-K715 PolarHBondContact O-N 3.3Å
716	T	85.8	Confident	70.5	Confident	39 Å²	39	95.4 Å²	95.4	24%	0.239	49%	0.491	C	S	.	.	S	Bend	trans	-73.3	150.4	171.2	59.9	0	0	0	0	110.8	V711 D718 Q719 L720	V711-T716 HydrophobicContact CB-CG2 4.37Å; V711-T716 HydrophobicContact CG2-CG2 3.63Å; T716-D718 VanDerWaalsContact C-N 3.32Å; T716-D718 PolarHBondContact O-N 3.14Å; T716-Q719 PolarHBondContact O-N 3.25Å; T716-Q719 VanDerWaalsContact O-N 3.11Å; T716-Q719 WeakPolarHBondContact OG1-CB 3.45Å; T716-Q719 VanDerWaalsContact OG1-CD 3.24Å; T716-Q719 VanDerWaalsContact OG1-CG 3.24Å; T716-Q719 WeakPolarHBondContact OG1-CG 3.38Å; T716-Q719 PolarHBondContact OG1-OE1 3.14Å; T716-L720 PolarHBondContact O-N 2.98Å
717	E	75.8	Confident	70.9	Confident	146 Å²	146	98.7 Å²	98.7	68%	0.682	49%	0.493	S	S	*	.	H	α-helix	trans	-47	-53.5	179.6	-157.1	77.1	-147.8	0	0	111.4	Q719 L720 I721	E717-Q719 PolarHBondContact O-N 3.21Å; E717-L720 WeakPolarHBondContact O-CB 3.3Å; E717-L720 PolarHBondContact O-N 3.45Å; E717-L720 VanDerWaalsContact O-N 3.14Å; E717-I721 HydrophobicContact CG-CD1 3.99Å; E717-I721 VanDerWaalsContact O-CG1 3.29Å; E717-I721 WeakPolarHBondContact O-CG1 3.46Å; E717-I721 PolarHBondContact O-N 3.02Å
718	D	77.6	Confident	71.2	Confident	120 Å²	120	98.5 Å²	98.5	64%	0.642	49%	0.488	S	S	*	.	H	α-helix	trans	-59.8	-41.7	-179.5	-59.3	-20	0	0	0	113.3	T716 L720 I721 M722	T716-D718 VanDerWaalsContact C-N 3.32Å; T716-D718 PolarHBondContact O-N 3.14Å; D718-L720 VanDerWaalsContact C-N 3.35Å; D718-I721 PolarHBondContact O-N 3.11Å; D718-M722 WeakPolarHBondContact O-CB 3.3Å; D718-M722 WeakPolarHBondContact O-CG 3.33Å; D718-M722 PolarHBondContact O-N 2.96Å
719	Q	74.9	Confident	71.3	Confident	69 Å²	69	98.8 Å²	98.8	32%	0.322	49%	0.491	S	S	.	.	H	α-helix	trans	-70.1	-34.9	178.3	-71.7	173.3	-18.1	0	0	111.4	G714 T716 E717 T723	G714-Q719 VanDerWaalsContact CA-OE1 3.24Å; T716-Q719 PolarHBondContact O-N 3.25Å; T716-Q719 VanDerWaalsContact O-N 3.11Å; T716-Q719 WeakPolarHBondContact OG1-CB 3.45Å; T716-Q719 VanDerWaalsContact OG1-CD 3.24Å; T716-Q719 VanDerWaalsContact OG1-CG 3.24Å; T716-Q719 WeakPolarHBondContact OG1-CG 3.38Å; T716-Q719 PolarHBondContact OG1-OE1 3.14Å; E717-Q719 PolarHBondContact O-N 3.21Å; Q719-T723 WeakPolarHBondContact O-CB 3.34Å; Q719-T723 PolarHBondContact O-N 2.94Å; Q719-T723 PolarHBondContact O-OG1 3.41Å
720	L	77.5	Confident	70.5	Confident	98 Å²	98	101.3 Å²	101.3	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-67.7	-44.1	174.3	-136.5	73.5	0	0	0	110.7	T716 E717 D718 T723 E724	T716-L720 PolarHBondContact O-N 2.98Å; E717-L720 WeakPolarHBondContact O-CB 3.3Å; E717-L720 PolarHBondContact O-N 3.45Å; E717-L720 VanDerWaalsContact O-N 3.14Å; D718-L720 VanDerWaalsContact C-N 3.35Å; L720-T723 PolarHBondContact O-N 3.49Å; L720-E724 WeakPolarHBondContact O-CB 3.4Å; L720-E724 PolarHBondContact O-N 3.36Å
721	I	75.1	Confident	69.9	Low	81 Å²	81	104.7 Å²	104.7	42%	0.415	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-47	175.4	-69.6	164.6	0	0	0	111	E717 D718 T723 E724 Q725	E717-I721 HydrophobicContact CG-CD1 3.99Å; E717-I721 VanDerWaalsContact O-CG1 3.29Å; E717-I721 WeakPolarHBondContact O-CG1 3.46Å; E717-I721 PolarHBondContact O-N 3.02Å; D718-I721 PolarHBondContact O-N 3.11Å; I721-T723 VanDerWaalsContact C-N 3.3Å; I721-T723 PolarHBondContact O-N 3.21Å; I721-E724 PolarHBondContact O-N 3.4Å; I721-Q725 WeakPolarHBondContact O-CG 3.41Å; I721-Q725 PolarHBondContact O-N 3.08Å
722	M	68.7	Low	68.7	Low	133 Å²	133	107 Å²	107	66%	0.655	54%	0.541	S	S	*	.	H	α-helix	trans	-59.6	-40.4	174.4	-76.6	-177.6	66.6	0	0	112.1	D718 A726	D718-M722 WeakPolarHBondContact O-CB 3.3Å; D718-M722 WeakPolarHBondContact O-CG 3.33Å; D718-M722 PolarHBondContact O-N 2.96Å; M722-A726 WeakPolarHBondContact O-CB 3.49Å; M722-A726 PolarHBondContact O-N 3.3Å
723	T	76	Confident	67.1	Low	63 Å²	63	112.4 Å²	112.4	39%	0.387	55%	0.551	S	S	.	*	H	α-helix	trans	-68.9	-36.9	178	-57.3	0	0	0	0	111.7	Q719 L720 I721 A726 R727	Q719-T723 WeakPolarHBondContact O-CB 3.34Å; Q719-T723 PolarHBondContact O-N 2.94Å; Q719-T723 PolarHBondContact O-OG1 3.41Å; L720-T723 PolarHBondContact O-N 3.49Å; I721-T723 VanDerWaalsContact C-N 3.3Å; I721-T723 PolarHBondContact O-N 3.21Å; T723-A726 PolarHBondContact O-N 3.25Å; T723-R727 WeakPolarHBondContact O-CG 3.39Å; T723-R727 PolarHBondContact O-N 3.19Å
724	E	72.3	Confident	66.1	Low	86 Å²	86	110 Å²	110	40%	0.402	55%	0.554	S	S	.	*	H	α-helix	trans	-73.3	-40	178.8	-161.7	60.8	-158.2	0	0	111.8	L720 I721 A726 R727 Q728	L720-E724 WeakPolarHBondContact O-CB 3.4Å; L720-E724 PolarHBondContact O-N 3.36Å; I721-E724 PolarHBondContact O-N 3.4Å; E724-A726 VanDerWaalsContact C-N 3.34Å; E724-A726 PolarHBondContact O-N 3.09Å; E724-R727 WeakPolarHBondContact O-CB 3.17Å; E724-R727 PolarHBondContact O-N 2.87Å; E724-R727 WeakPolarHBondContact OE2-CD 3.29Å; E724-R727 IonicContact OE2-CZ 3.72Å; E724-R727 IonicContact OE2-NE 2.73Å; E724-R727 IonicContact OE2-NH1 2.84Å; E724-R727 PolarHBondContact OE2-NH1 3.05Å; E724-Q728 WeakPolarHBondContact O-CG 3.42Å; E724-Q728 PolarHBondContact O-N 3.29Å
725	Q	69.2	Low	64.3	Low	102 Å²	102	114.4 Å²	114.4	48%	0.477	58%	0.58	S	S	.	*	H	α-helix	trans	-59	-44.7	168.3	-75.3	-175.4	-16.7	0	0	111.4	I721 R727 Q728 Y729	I721-Q725 WeakPolarHBondContact O-CG 3.41Å; I721-Q725 PolarHBondContact O-N 3.08Å; Q725-R727 VanDerWaalsContact C-N 3.28Å; Q725-R727 PolarHBondContact O-N 2.94Å; Q725-Q728 WeakPolarHBondContact O-CB 3.44Å; Q725-Q728 PolarHBondContact O-N 3.16Å; Q725-Q728 VanDerWaalsContact O-N 3.09Å; Q725-Y729 WeakPolarHBondContact O-CD2 3.32Å; Q725-Y729 PolarHBondContact O-N 3.28Å
726	A	64.6	Low	62.9	Low	49 Å²	49	113.6 Å²	113.6	41%	0.405	59%	0.592	S	S	.	*	H	α-helix	trans	-60.6	-35.3	175.8	0	0	0	0	0	112.7	M722 T723 E724 L730	M722-A726 WeakPolarHBondContact O-CB 3.49Å; M722-A726 PolarHBondContact O-N 3.3Å; T723-A726 PolarHBondContact O-N 3.25Å; E724-A726 VanDerWaalsContact C-N 3.34Å; E724-A726 PolarHBondContact O-N 3.09Å; A726-L730 WeakPolarHBondContact O-CB 3.48Å; A726-L730 VanDerWaalsContact O-CG 3.32Å; A726-L730 WeakPolarHBondContact O-CG 3.35Å; A726-L730 PolarHBondContact O-N 3.09Å
727	R	68.9	Low	60.6	Low	134 Å²	134	115.3 Å²	115.3	51%	0.506	62%	0.617	S	S	.	*	H	α-helix	trans	-68	-38.8	171.8	-72.3	170.3	-174.9	151.9	2.4	112.8	T723 E724 Q725 Y729 L730 T731	T723-R727 WeakPolarHBondContact O-CG 3.39Å; T723-R727 PolarHBondContact O-N 3.19Å; E724-R727 WeakPolarHBondContact O-CB 3.17Å; E724-R727 PolarHBondContact O-N 2.87Å; E724-R727 WeakPolarHBondContact OE2-CD 3.29Å; E724-R727 IonicContact OE2-CZ 3.72Å; E724-R727 IonicContact OE2-NE 2.73Å; E724-R727 IonicContact OE2-NH1 2.84Å; E724-R727 PolarHBondContact OE2-NH1 3.05Å; Q725-R727 VanDerWaalsContact C-N 3.28Å; Q725-R727 PolarHBondContact O-N 2.94Å; R727-Y729 VanDerWaalsContact C-N 3.34Å; R727-Y729 PolarHBondContact O-N 2.79Å; R727-L730 CarbonylContact O-C 3.6Å; R727-L730 PolarHBondContact O-N 2.91Å; R727-L730 VanDerWaalsContact O-N 3.11Å; R727-T731 WeakPolarHBondContact O-CB 3.38Å; R727-T731 PolarHBondContact O-N 3.18Å; R727-T731 PolarHBondContact O-OG1 3.07Å
728	Q	62.2	Low	58.6	Low	129 Å²	129	114.2 Å²	114.2	60%	0.603	63%	0.625	S	S	*	*	H	α-helix	trans	-61.9	-41.6	176.3	-70.2	170.7	13.5	0	0	111.2	E724 Q725 L730 T731	E724-Q728 WeakPolarHBondContact O-CG 3.42Å; E724-Q728 PolarHBondContact O-N 3.29Å; Q725-Q728 WeakPolarHBondContact O-CB 3.44Å; Q725-Q728 PolarHBondContact O-N 3.16Å; Q725-Q728 VanDerWaalsContact O-N 3.09Å; Q728-L730 VanDerWaalsContact C-N 3.29Å; Q728-L730 PolarHBondContact O-N 3.48Å; Q728-T731 PolarHBondContact O-N 2.95Å
729	Y	56.8	Low	56.8	Low	206 Å²	206	114.9 Å²	114.9	81%	0.808	63%	0.634	S	S	*	*	H	α-helix	trans	-68.7	-21.8	173.1	-70.6	-64.9	0	0	0	114.6	Q725 R727	Q725-Y729 WeakPolarHBondContact O-CD2 3.32Å; Q725-Y729 PolarHBondContact O-N 3.28Å; R727-Y729 VanDerWaalsContact C-N 3.34Å; R727-Y729 PolarHBondContact O-N 2.79Å
730	L	51.2	Low	55.2	Low	146 Å²	146	117.5 Å²	117.5	76%	0.764	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	1.7	177.9	-70.4	172.5	0	0	0	114	A726 R727 Q728 P732	A726-L730 WeakPolarHBondContact O-CB 3.48Å; A726-L730 VanDerWaalsContact O-CG 3.32Å; A726-L730 WeakPolarHBondContact O-CG 3.35Å; A726-L730 PolarHBondContact O-N 3.09Å; R727-L730 CarbonylContact O-C 3.6Å; R727-L730 PolarHBondContact O-N 2.91Å; R727-L730 VanDerWaalsContact O-N 3.11Å; Q728-L730 VanDerWaalsContact C-N 3.29Å; Q728-L730 PolarHBondContact O-N 3.48Å; L730-P732 WeakPolarHBondContact O-CD 3.48Å
731	T	54.3	Low	53.3	Low	92 Å²	92	124.6 Å²	124.6	56%	0.564	68%	0.68	S	S	*	*	S	Bend	trans	-106	108	179.7	-56.8	0	0	0	0	110.2	R727 Q728 Y733	R727-T731 WeakPolarHBondContact O-CB 3.38Å; R727-T731 PolarHBondContact O-N 3.18Å; R727-T731 PolarHBondContact O-OG1 3.07Å; Q728-T731 PolarHBondContact O-N 2.95Å; T731-Y733 PolarHBondContact O-N 2.98Å
732	P	47.5	Very low	52.1	Low	117 Å²	117	125.1 Å²	125.1	76%	0.76	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-63	126.6	174.8	-20	32.6	0	0	0	110.4	L730	L730-P732 WeakPolarHBondContact O-CD 3.48Å
733	Y	39.7	Very low	50.6	Low	225 Å²	225	126.1 Å²	126.1	88%	0.882	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-58.7	132.2	177.3	-104.3	-96.2	0	0	0	110.8	T731 S735	T731-Y733 PolarHBondContact O-N 2.98Å; Y733-S735 PolarHBondContact O-N 3.46Å
734	P	45.3	Very low	48.9	Very low	104 Å²	104	129.2 Å²	129.2	68%	0.675	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69	133.2	179.4	27.9	-34	0	0	0	110.9	S736	P734-S736 PolarHBondContact O-N 3.4Å; P734-S736 VanDerWaalsContact O-N 3.12Å
735	S	34.4	Very low	47.5	Very low	126 Å²	126	136.3 Å²	136.3	88%	0.881	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-59.4	116.7	174.5	-174.3	0	0	0	0	110.3	Y733 G737	Y733-S735 PolarHBondContact O-N 3.46Å; S735-G737 PolarHBondContact O-N 2.71Å
736	S	42.8	Very low	46.4	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	78%	0.776	S	S	*	*			trans	-90.2	100.6	-178.5	-66.3	0	0	0	0	110	P734	P734-S736 PolarHBondContact O-N 3.4Å; P734-S736 VanDerWaalsContact O-N 3.12Å
737	G	38.7	Very low	45.4	Very low	75 Å²	75	142.7 Å²	142.7	77%	0.773	80%	0.795	S	S	*	*			trans	160.7	68.1	173	0	0	0	0	0	118	S735	S735-G737 PolarHBondContact O-N 2.71Å
738	S	33.1	Very low	44.1	Very low	123 Å²	123	143.2 Å²	143.2	86%	0.86	81%	0.811	S	S	*	*			trans	-163.4	149.3	135.7	-161.6	0	0	0	0	111.1
739	T	40.2	Very low	43.1	Very low	135 Å²	135	144.1 Å²	144.1	83%	0.828	82%	0.824	S	S	*	*			trans	-86.3	152.2	-173	41.4	0	0	0	0	114
740	S	41.7	Very low	42.2	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	83%	0.825	S	S	*	*			trans	-48.4	134.9	176.5	-42.5	0	0	0	0	114.8
741	R	36.9	Very low	41.6	Very low	248 Å²	248	139.8 Å²	139.8	94%	0.936	83%	0.829	S	S	*	*			trans	-151.8	127.7	142.3	-148.3	165.9	-175.8	147.6	0.2	111.4
742	A	49.6	Very low	40.7	Very low	91 Å²	91	143.2 Å²	143.2	75%	0.752	85%	0.847	S	S	*	*			trans	-101.5	137.2	178.5	0	0	0	0	0	111.3
743	L	37.6	Very low	40.2	Very low	155 Å²	155	145.2 Å²	145.2	81%	0.812	85%	0.854	S	S	*	*			trans	-140.6	127.3	155.4	-71.9	178.8	0	0	0	104.6
744	V	39.1	Very low	40.2	Very low	127 Å²	127	138.6 Å²	138.6	77%	0.77	85%	0.852	S	S	*	*				59.8	115	72.6	-178.8	0	0	0	0	109.1
745	L	43.5	Very low	39.8	Very low	236 Å²	236	141.7 Å²	141.7	100%	1.236	87%	0.868	S	S	*	*			cis	-135.2	0	25.7	-140.5	163.4	0	0	0	111.9

Retrieved 745 of 745 residues in 759.3 ms (Link to these results)

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