A0A077Z2D4_TRITR Loading...

26S proteasome non-ATPase regulatory subunit 6

AlphaFold DB , UniProt , Accession A0A077Z2D4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 547 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	44.8	Very low	40	Very low	230 Å²	230	138.2 Å²	138.2	100%	1.133	79%	0.79	S	S	*	*				0	121.9	0	-74.2	165.5	163.7	0	0	106.1
2	D	36.8	Very low	39.7	Very low	142 Å²	142	139 Å²	139	76%	0.759	78%	0.782	S	S	*	*			trans	60.1	135.5	159.7	-48.9	-47.1	0	0	0	118.9
3	S	36.9	Very low	39.2	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	78%	0.784	S	S	*	*			cis	75.4	135.6	40.3	-57.4	0	0	0	0	112.9
4	S	39.7	Very low	39	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	80%	0.795	S	S	*	*			cis	-165.4	166.7	-6.6	49.8	0	0	0	0	113
5	A	40.2	Very low	38.6	Very low	108 Å²	108	141.8 Å²	141.8	89%	0.893	80%	0.798	S	S	*	*			trans	12.9	148.8	150.7	0	0	0	0	0	124.5
6	G	41.7	Very low	38.5	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	80%	0.8	S	S	*	*			trans	151.5	101.5	163.5	0	0	0	0	0	110.8
7	Q	39.4	Very low	38	Very low	181 Å²	181	142.1 Å²	142.1	85%	0.846	81%	0.806	S	S	*	*			cis	94	142.8	35.7	-159.9	-171.8	34.6	0	0	113.1
8	K	39.9	Very low	37.8	Very low	169 Å²	169	142.9 Å²	142.9	74%	0.735	81%	0.807	S	S	*	*			trans	85.8	155.6	175.1	-57.3	-172.7	175.7	-174.2	0	116
9	D	41.1	Very low	37.4	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	80%	0.802	S	S	*	*			cis	-171.1	160.5	-20.5	-94.7	-21.2	0	0	0	107.8
10	V	40.4	Very low	37	Very low	111 Å²	111	142.9 Å²	142.9	67%	0.673	80%	0.796	S	S	*	*			cis	-169.9	165	-30.7	92.7	0	0	0	0	109.4
11	K	38.9	Very low	37	Very low	159 Å²	159	145.6 Å²	145.6	69%	0.691	80%	0.799	S	S	*	*			trans	66.2	164.1	169.8	-82.8	162.2	164.1	-94	0	117.6
12	E	36.3	Very low	36.2	Very low	148 Å²	148	139.9 Å²	139.9	69%	0.692	78%	0.782	S	S	*	*			cis	-139.4	-177.5	-3	-155.1	102.4	-128.1	0	0	111.1
13	K	32.8	Very low	35.9	Very low	186 Å²	186	140.9 Å²	140.9	81%	0.809	78%	0.782	S	S	*	*			trans	-99.6	156.2	-173.9	-54.1	164.1	-179.3	170.5	0	112.8
14	T	37.4	Very low	35.8	Very low	153 Å²	153	143.3 Å²	143.3	94%	0.939	79%	0.787	S	S	*	*				-170.3	171.8	118.4	17.2	0	0	0	0	112
15	S	32.1	Very low	35.3	Very low	120 Å²	120	148.2 Å²	148.2	84%	0.839	80%	0.795	S	S	*	*			trans	-109	141.9	-160.4	54.3	0	0	0	0	115.4
16	G	37.8	Very low	34.9	Very low	80 Å²	80	147.5 Å²	147.5	83%	0.825	79%	0.788	S	S	*	*			trans	-142.6	134.9	160.2	0	0	0	0	0	110.2
17	K	30.1	Very low	34.5	Very low	208 Å²	208	153.8 Å²	153.8	90%	0.904	80%	0.795	S	S	*	*			trans	-132.7	93.1	-172.6	-177.1	-161.9	172.5	-171.6	0	112
18	L	34.9	Very low	34.3	Very low	157 Å²	157	149.7 Å²	149.7	82%	0.822	79%	0.786	S	S	*	*			trans	-157.2	154.4	164.9	-76	174	0	0	0	105.5
19	E	29.4	Very low	34	Very low	152 Å²	152	147.9 Å²	147.9	71%	0.71	79%	0.785	S	S	*	*			cis	-172.8	149.6	-32.5	-120.9	-172	159.4	0	0	103.6
20	I	29.7	Very low	33.7	Very low	134 Å²	134	146.9 Å²	146.9	69%	0.687	78%	0.779	S	S	*	*			trans	49.9	105.8	153.4	-51.5	164.1	0	0	0	118.1
21	K	36.3	Very low	33.4	Very low	200 Å²	200	150 Å²	150	87%	0.87	79%	0.787	S	S	*	*				-145.8	107.5	129.2	-113.2	175.6	-175.3	-177	0	109.8
22	S	27.8	Very low	33.3	Very low	110 Å²	110	151.1 Å²	151.1	77%	0.769	79%	0.791	S	S	*	*			trans	-109.8	85.1	-168.4	54.2	0	0	0	0	111.2
23	E	31.4	Very low	33.1	Very low	162 Å²	162	153.5 Å²	153.5	76%	0.757	79%	0.794	S	S	*	*			trans	-130.5	158.6	175.7	-64.3	-178.7	153.1	0	0	109.4
24	N	33.4	Very low	33.2	Very low	158 Å²	158	151.8 Å²	151.8	85%	0.845	79%	0.794	S	S	*	*	S	Bend	trans	71.5	44.9	178.2	-52.5	-31.9	0	0	0	118.4
25	F	30.1	Very low	33	Very low	215 Å²	215	148.7 Å²	148.7	94%	0.943	78%	0.784	S	S	*	*	S	Bend	trans	-143.1	8.6	159.7	-117.6	-78.8	0	0	0	116.1
26	A	32	Very low	33	Very low	92 Å²	92	151 Å²	151	76%	0.76	79%	0.786	S	S	*	*	S	Bend	trans	-127.2	31.9	-166.5	0	0	0	0	0	115.1
27	K	33	Very low	32.7	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	78%	0.781	S	S	*	*	S	Bend	trans	-133.3	52.4	179.7	-71.1	-169.6	173.5	-176.1	0	112.9
28	S	34.9	Very low	32.7	Very low	94 Å²	94	150.3 Å²	150.3	66%	0.657	78%	0.778	S	S	*	*	S	Bend	trans	-150.4	-9.2	178.5	-156.5	0	0	0	0	115.9
29	N	34.5	Very low	32.5	Very low	132 Å²	132	146.6 Å²	146.6	71%	0.706	78%	0.777	S	S	*	*	S	Bend	trans	-104.9	-19.8	-173.3	-91.2	-12.9	0	0	0	115.4
30	D	35.1	Very low	32.9	Very low	108 Å²	108	144.5 Å²	144.5	58%	0.578	78%	0.775	S	S	*	*	S	Bend	trans	-93.3	-21.9	-173.5	-63.8	-59.6	0	0	0	114.1	K32 R33	D30-K32 PolarHBondContact O-N 3.24Å; D30-R33 PolarHBondContact O-N 3.5Å; D30-R33 IonicContact OD1-NH1 3.84Å
31	E	34.6	Very low	33.2	Very low	177 Å²	177	145.2 Å²	145.2	83%	0.827	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-14.2	171.6	-72.3	178.4	135.1	0	0	113	R33	E31-R33 VanDerWaalsContact C-N 3.33Å
32	K	35.2	Very low	33.4	Very low	182 Å²	182	141.9 Å²	141.9	79%	0.791	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	10.7	173.4	-69	-167.5	174.1	-173.3	0	114.3	D30	D30-K32 PolarHBondContact O-N 3.24Å
33	R	33.7	Very low	34	Very low	198 Å²	198	139.9 Å²	139.9	75%	0.747	76%	0.758	S	S	*	*	S	Bend	trans	-104.3	-11.5	179.1	-92.3	179.6	160.5	143.9	-5.3	116.4	D30 E31	D30-R33 PolarHBondContact O-N 3.5Å; D30-R33 IonicContact OD1-NH1 3.84Å; E31-R33 VanDerWaalsContact C-N 3.33Å
34	N	34.5	Very low	34.4	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	75%	0.75	S	S	*	*	S	Bend	trans	-108.6	4.9	-178.8	-80.4	3.6	0	0	0	115	L36	N34-L36 VanDerWaalsContact C-N 3.26Å; N34-L36 PolarHBondContact O-N 2.74Å
35	A	33.6	Very low	34.7	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	74%	0.741	S	S	*	*			trans	-79.6	70.2	175.2	0	0	0	0	0	111.4
36	L	31.2	Very low	35.3	Very low	167 Å²	167	129.4 Å²	129.4	87%	0.874	72%	0.718	S	S	*	*			trans	-116.8	36.5	176.9	-162.3	69	0	0	0	112.1	N34	N34-L36 VanDerWaalsContact C-N 3.26Å; N34-L36 PolarHBondContact O-N 2.74Å
37	T	32.2	Very low	35.8	Very low	119 Å²	119	128.6 Å²	128.6	73%	0.73	70%	0.701	S	S	*	*	S	Bend	trans	-146.7	149.4	167.8	42.5	0	0	0	0	108.4
38	D	30	Very low	36.4	Very low	155 Å²	155	125.3 Å²	125.3	83%	0.829	69%	0.689	S	S	*	*			trans	82.1	91.6	179.7	-57	-14.2	0	0	0	116.2
39	G	29.7	Very low	37	Very low	79 Å²	79	124.9 Å²	124.9	81%	0.814	69%	0.686	S	S	*	*			trans	-101.4	92.9	174.8	0	0	0	0	0	113
40	T	37.9	Very low	37.8	Very low	108 Å²	108	120.8 Å²	120.8	66%	0.663	67%	0.666	S	S	*	*			trans	-142.9	-34.9	172.3	38	0	0	0	0	114.4	S43	T40-S43 PolarHBondContact O-OG 3.34Å; T40-S43 VanDerWaalsContact O-OG 3.06Å
41	E	35.4	Very low	38.5	Very low	149 Å²	149	118.6 Å²	118.6	70%	0.696	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-28.9	-162.4	-56.9	-154.2	117.8	0	0	115.6	S43 K44	E41-S43 PolarHBondContact O-N 2.85Å; E41-K44 PolarHBondContact O-N 2.89Å
42	T	40.9	Very low	39.4	Very low	131 Å²	131	114.7 Å²	114.7	80%	0.804	64%	0.642	S	S	*	*	H	α-helix	trans	-64.2	-7.7	-177.2	52.8	0	0	0	0	115
43	S	41.5	Very low	39.8	Very low	67 Å²	67	109 Å²	109	47%	0.469	63%	0.628	S	S	.	*	H	α-helix	trans	-82.4	-23.3	178.6	65	0	0	0	0	114.3	T40 E41 N47	T40-S43 PolarHBondContact O-OG 3.34Å; T40-S43 VanDerWaalsContact O-OG 3.06Å; E41-S43 PolarHBondContact O-N 2.85Å; S43-N47 PolarHBondContact O-N 2.98Å; S43-N47 PolarHBondContact O-ND2 2.73Å
44	K	40	Very low	40.3	Very low	136 Å²	136	100.3 Å²	100.3	59%	0.591	60%	0.597	S	S	*	*	H	α-helix	trans	-74.6	-56.6	-176.4	-75.2	176.6	-179.3	165.5	0	111.9	E41 A46 N47 E48	E41-K44 PolarHBondContact O-N 2.89Å; K44-A46 PolarHBondContact O-N 3.37Å; K44-N47 WeakPolarHBondContact O-CA 3.04Å; K44-N47 WeakPolarHBondContact O-CB 3.37Å; K44-N47 PolarHBondContact O-N 3.08Å; K44-E48 PolarHBondContact O-N 3.08Å
45	D	39.1	Very low	40.7	Very low	122 Å²	122	98.2 Å²	98.2	65%	0.652	58%	0.582	S	S	*	*	H	α-helix	trans	-59.4	-35.7	-174.9	-53	7.6	0	0	0	112	E48 S49	D45-E48 PolarHBondContact O-N 3.25Å; D45-S49 WeakPolarHBondContact O-CB 3.44Å; D45-S49 PolarHBondContact O-N 3.07Å
46	A	42.2	Very low	41.1	Very low	57 Å²	57	96.9 Å²	96.9	47%	0.471	57%	0.57	S	S	.	*	H	α-helix	trans	-64.5	-42.4	173.9	0	0	0	0	0	112.4	K44 V50	K44-A46 PolarHBondContact O-N 3.37Å; A46-V50 WeakPolarHBondContact O-CG2 3.43Å; A46-V50 PolarHBondContact O-N 3.04Å; A46-V50 VanDerWaalsContact O-N 3.16Å
47	N	42.3	Very low	41.7	Very low	75 Å²	75	92.2 Å²	92.2	40%	0.401	55%	0.549	S	S	.	.	H	α-helix	trans	-68.1	-38	176.4	-83.1	-69.7	0	0	0	112.1	S43 K44 M51	S43-N47 PolarHBondContact O-N 2.98Å; S43-N47 PolarHBondContact O-ND2 2.73Å; K44-N47 WeakPolarHBondContact O-CA 3.04Å; K44-N47 WeakPolarHBondContact O-CB 3.37Å; K44-N47 PolarHBondContact O-N 3.08Å; N47-M51 WeakPolarHBondContact O-CB 3.39Å; N47-M51 WeakPolarHBondContact O-CG 3.44Å; N47-M51 PolarHBondContact O-N 3.22Å
48	E	45.8	Very low	42.1	Very low	136 Å²	136	88.7 Å²	88.7	64%	0.636	53%	0.532	S	S	*	.	H	α-helix	trans	-66.9	-40.3	176.6	-67.5	-166.8	164.6	0	0	112.3	K44 D45 M51 T52	K44-E48 PolarHBondContact O-N 3.08Å; D45-E48 PolarHBondContact O-N 3.25Å; E48-M51 PolarHBondContact O-N 3.35Å; E48-T52 PolarHBondContact O-N 3.01Å; E48-T52 VanDerWaalsContact O-N 3.09Å; E48-T52 PolarHBondContact O-OG1 2.94Å
49	S	48.4	Very low	42.5	Very low	85 Å²	85	85.2 Å²	85.2	59%	0.594	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-45.9	175.1	-171.6	0	0	0	0	112.5	D45 M51 T52 A53	D45-S49 WeakPolarHBondContact O-CB 3.44Å; D45-S49 PolarHBondContact O-N 3.07Å; S49-M51 VanDerWaalsContact C-N 3.34Å; S49-M51 PolarHBondContact O-N 3.12Å; S49-T52 PolarHBondContact O-N 2.69Å; S49-A53 PolarHBondContact O-N 2.96Å
50	V	50.9	Low	43	Very low	47 Å²	47	85.3 Å²	85.3	29%	0.285	50%	0.502	S	S	.	.	H	α-helix	trans	-65.2	-36.5	176.5	171.4	0	0	0	0	111.8	A46 L54	A46-V50 WeakPolarHBondContact O-CG2 3.43Å; A46-V50 PolarHBondContact O-N 3.04Å; A46-V50 VanDerWaalsContact O-N 3.16Å; V50-L54 HydrophobicContact CG1-CD1 4.48Å; V50-L54 WeakPolarHBondContact O-CB 3.42Å; V50-L54 PolarHBondContact O-N 2.95Å; V50-L54 VanDerWaalsContact O-N 3.17Å
51	M	48.9	Very low	43.1	Very low	61 Å²	61	83 Å²	83	30%	0.3	49%	0.488	S	S	.	.	H	α-helix	trans	-65.3	-42.7	178.1	-77.5	-76.4	-74.4	0	0	112.5	N47 E48 S49 L54 E55 K403	N47-M51 WeakPolarHBondContact O-CB 3.39Å; N47-M51 WeakPolarHBondContact O-CG 3.44Å; N47-M51 PolarHBondContact O-N 3.22Å; E48-M51 PolarHBondContact O-N 3.35Å; S49-M51 VanDerWaalsContact C-N 3.34Å; S49-M51 PolarHBondContact O-N 3.12Å; M51-L54 WeakPolarHBondContact O-CB 3.26Å; M51-L54 PolarHBondContact O-N 2.99Å; M51-E55 PolarHBondContact O-N 3.14Å; M51-K403 HydrophobicContact CE-CB 4.47Å; M51-K403 HydrophobicContact CE-CD 3.89Å; M51-K403 HydrophobicContact CE-CG 4.03Å; M51-K403 HydrophobicContact SD-CD 4.18Å; M51-K403 HydrophobicContact SD-CG 4.31Å
52	T	53.5	Low	43.3	Very low	96 Å²	96	80.9 Å²	80.9	59%	0.589	48%	0.481	S	S	*	.	H	α-helix	trans	-63.5	-42.6	177.5	-46.5	0	0	0	0	111.8	E48 S49 L54 E55 A56	E48-T52 PolarHBondContact O-N 3.01Å; E48-T52 VanDerWaalsContact O-N 3.09Å; E48-T52 PolarHBondContact O-OG1 2.94Å; S49-T52 PolarHBondContact O-N 2.69Å; T52-L54 PolarHBondContact O-N 3.42Å; T52-E55 PolarHBondContact O-N 3.4Å; T52-E55 VanDerWaalsContact O-N 3.11Å; T52-A56 PolarHBondContact O-N 2.84Å
53	A	43.3	Very low	43.3	Very low	61 Å²	61	78.9 Å²	78.9	50%	0.504	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-31.9	175.9	0	0	0	0	0	112.9	S49 E55	S49-A53 PolarHBondContact O-N 2.96Å; A53-E55 VanDerWaalsContact C-N 3.31Å
54	L	45.4	Very low	43.1	Very low	17 Å²	17	80.6 Å²	80.6	9%	0.089	46%	0.463	C	S	.	.	H	α-helix	trans	-73.2	-17.2	175.3	-107.5	166.9	0	0	0	114.3	V50 M51 T52 T57 A58 I438	V50-L54 HydrophobicContact CG1-CD1 4.48Å; V50-L54 WeakPolarHBondContact O-CB 3.42Å; V50-L54 PolarHBondContact O-N 2.95Å; V50-L54 VanDerWaalsContact O-N 3.17Å; M51-L54 WeakPolarHBondContact O-CB 3.26Å; M51-L54 PolarHBondContact O-N 2.99Å; T52-L54 PolarHBondContact O-N 3.42Å; L54-T57 PolarHBondContact O-OG1 3.31Å; L54-A58 WeakPolarHBondContact O-CB 3.41Å; L54-A58 PolarHBondContact O-N 3.24Å; L54-I438 HydrophobicContact CD1-CG2 3.79Å; L54-I438 HydrophobicContact CD2-CD1 4.09Å; L54-I438 HydrophobicContact CD2-CG2 4.13Å; L54-I438 HydrophobicContact CG-CD1 4.44Å; L54-I438 HydrophobicContact CG-CG2 3.94Å
55	E	42.4	Very low	43.2	Very low	107 Å²	107	79.2 Å²	79.2	50%	0.5	46%	0.461	S	S	.	.	H	α-helix	trans	-87.7	-33.4	177.8	-73	175.8	175.9	0	0	111.5	M51 T52 A53 A58 T59	M51-E55 PolarHBondContact O-N 3.14Å; T52-E55 PolarHBondContact O-N 3.4Å; T52-E55 VanDerWaalsContact O-N 3.11Å; A53-E55 VanDerWaalsContact C-N 3.31Å; E55-A58 PolarHBondContact O-N 3.02Å; E55-T59 PolarHBondContact O-N 2.94Å; E55-T59 VanDerWaalsContact O-N 3.07Å; E55-T59 PolarHBondContact O-OG1 3.37Å
56	A	41.7	Very low	42.9	Very low	59 Å²	59	81.8 Å²	81.8	49%	0.488	46%	0.461	S	S	.	.	H	α-helix	trans	-58.8	-52.8	170.8	0	0	0	0	0	111.9	T52 A58 T59 T60	T52-A56 PolarHBondContact O-N 2.84Å; A56-A58 VanDerWaalsContact C-N 3.32Å; A56-A58 PolarHBondContact O-N 3.49Å; A56-T59 PolarHBondContact O-N 3.39Å; A56-T60 PolarHBondContact O-N 3.49Å; A56-T60 VanDerWaalsContact O-N 3.1Å; A56-T60 PolarHBondContact O-OG1 3.28Å
57	T	44.1	Very low	42.7	Very low	69 Å²	69	85.3 Å²	85.3	42%	0.423	47%	0.468	S	S	.	.	H	α-helix	trans	-65.5	-33.1	-179.5	52.5	0	0	0	0	113.2	L54 T59 T61	L54-T57 PolarHBondContact O-OG1 3.31Å; T57-T59 VanDerWaalsContact C-N 3.28Å; T57-T59 PolarHBondContact O-N 3.45Å; T57-T61 WeakPolarHBondContact O-CG2 3.1Å; T57-T61 PolarHBondContact O-N 3.45Å; T57-T61 PolarHBondContact O-OG1 2.97Å
58	A	39.9	Very low	42.5	Very low	46 Å²	46	88.2 Å²	88.2	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-70.1	-22.2	172.6	0	0	0	0	0	113.3	L54 E55 A56 N62	L54-A58 WeakPolarHBondContact O-CB 3.41Å; L54-A58 PolarHBondContact O-N 3.24Å; E55-A58 PolarHBondContact O-N 3.02Å; A56-A58 VanDerWaalsContact C-N 3.32Å; A56-A58 PolarHBondContact O-N 3.49Å; A58-N62 PolarHBondContact O-ND2 3.42Å
59	T	39.6	Very low	42	Very low	81 Å²	81	85.6 Å²	85.6	50%	0.497	48%	0.48	S	S	.	.	H	α-helix	trans	-83.6	-50.7	177.6	-52.8	0	0	0	0	110.6	E55 A56 T57 T61 N62 E63	E55-T59 PolarHBondContact O-N 2.94Å; E55-T59 VanDerWaalsContact O-N 3.07Å; E55-T59 PolarHBondContact O-OG1 3.37Å; A56-T59 PolarHBondContact O-N 3.39Å; T57-T59 VanDerWaalsContact C-N 3.28Å; T57-T59 PolarHBondContact O-N 3.45Å; T59-T61 VanDerWaalsContact C-N 3.27Å; T59-T61 PolarHBondContact O-N 3.45Å; T59-N62 PolarHBondContact O-N 3.41Å; T59-E63 PolarHBondContact O-N 2.89Å; T59-E63 VanDerWaalsContact O-N 3.12Å
60	T	40.1	Very low	41.3	Very low	82 Å²	82	85.4 Å²	85.4	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-53.7	-43.4	178.3	-48.6	0	0	0	0	112.4	A56 N62 E63 E64	A56-T60 PolarHBondContact O-N 3.49Å; A56-T60 VanDerWaalsContact O-N 3.1Å; A56-T60 PolarHBondContact O-OG1 3.28Å; T60-N62 PolarHBondContact O-N 2.98Å; T60-E63 PolarHBondContact O-N 3.25Å; T60-E64 PolarHBondContact O-N 3.46Å; T60-E64 VanDerWaalsContact O-N 3.15Å
61	T	40.9	Very low	40.6	Very low	60 Å²	60	91.6 Å²	91.6	37%	0.368	51%	0.505	S	S	.	.	H	α-helix	trans	-70.9	-11.8	-179.9	49.1	0	0	0	0	114.8	T57 T59 I65	T57-T61 WeakPolarHBondContact O-CG2 3.1Å; T57-T61 PolarHBondContact O-N 3.45Å; T57-T61 PolarHBondContact O-OG1 2.97Å; T59-T61 VanDerWaalsContact C-N 3.27Å; T59-T61 PolarHBondContact O-N 3.45Å; T61-I65 WeakPolarHBondContact O-CD1 3.34Å; T61-I65 WeakPolarHBondContact O-CG1 3.15Å
62	N	38.8	Very low	39.7	Very low	103 Å²	103	98 Å²	98	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-94.4	-35.4	170.7	-80.1	-70.4	0	0	0	112.2	A58 T59 T60 I65 R66	A58-N62 PolarHBondContact O-ND2 3.42Å; T59-N62 PolarHBondContact O-N 3.41Å; T60-N62 PolarHBondContact O-N 2.98Å; N62-I65 PolarHBondContact O-N 2.9Å; N62-R66 WeakPolarHBondContact O-CB 3.16Å; N62-R66 PolarHBondContact O-N 3.19Å
63	E	39.7	Very low	38.6	Very low	90 Å²	90	99.8 Å²	99.8	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-64.5	-44.6	176.6	-132.8	64.5	-125.6	0	0	111.3	T59 T60 I65 R66 E67	T59-E63 PolarHBondContact O-N 2.89Å; T59-E63 VanDerWaalsContact O-N 3.12Å; T60-E63 PolarHBondContact O-N 3.25Å; E63-I65 PolarHBondContact O-N 3.2Å; E63-R66 WeakPolarHBondContact O-CB 3.35Å; E63-R66 PolarHBondContact O-N 3.48Å; E63-R66 WeakPolarHBondContact OE1-CD 3.22Å; E63-R66 IonicContact OE1-NE 2.83Å; E63-E67 PolarHBondContact O-N 3.47Å
64	E	38.1	Very low	38	Very low	102 Å²	102	100.2 Å²	100.2	48%	0.477	55%	0.553	S	S	.	*	H	α-helix	trans	-57.4	-35.1	174.4	-72.6	-178.1	166.7	0	0	113	T60 N68	T60-E64 PolarHBondContact O-N 3.46Å; T60-E64 VanDerWaalsContact O-N 3.15Å; E64-N68 WeakPolarHBondContact O-CB 3.43Å; E64-N68 PolarHBondContact O-N 3.34Å; E64-N68 PolarHBondContact O-ND2 2.97Å
65	I	41.4	Very low	37.3	Very low	108 Å²	108	107.5 Å²	107.5	55%	0.554	59%	0.592	S	S	*	*	H	α-helix	trans	-74.2	-32.8	177.7	-67.8	175.7	0	0	0	110.9	T61 N62 E63 S69	T61-I65 WeakPolarHBondContact O-CD1 3.34Å; T61-I65 WeakPolarHBondContact O-CG1 3.15Å; N62-I65 PolarHBondContact O-N 2.9Å; E63-I65 PolarHBondContact O-N 3.2Å; I65-S69 WeakPolarHBondContact O-CB 3.34Å; I65-S69 PolarHBondContact O-N 3.43Å; I65-S69 PolarHBondContact O-OG 3.22Å
66	R	34.6	Very low	36.6	Very low	175 Å²	175	106.9 Å²	106.9	66%	0.66	60%	0.6	S	S	*	*	H	α-helix	trans	-73.4	-48	-178.4	179.2	172.2	160	78.4	3.7	111.7	N62 E63 S69 S70	N62-R66 WeakPolarHBondContact O-CB 3.16Å; N62-R66 PolarHBondContact O-N 3.19Å; E63-R66 WeakPolarHBondContact O-CB 3.35Å; E63-R66 PolarHBondContact O-N 3.48Å; E63-R66 WeakPolarHBondContact OE1-CD 3.22Å; E63-R66 IonicContact OE1-NE 2.83Å; R66-S69 PolarHBondContact O-N 3.06Å; R66-S69 VanDerWaalsContact O-N 3.15Å; R66-S70 PolarHBondContact O-N 3.45Å; R66-S70 PolarHBondContact O-OG 3.06Å
67	E	37.6	Very low	36.3	Very low	132 Å²	132	114 Å²	114	62%	0.617	62%	0.62	S	S	*	*	H	α-helix	trans	-64.1	-46.8	179.3	-66.3	-174.3	144.9	0	0	111.9	E63 S69 S70	E63-E67 PolarHBondContact O-N 3.47Å; E67-S69 PolarHBondContact O-N 2.91Å; E67-S70 PolarHBondContact O-N 2.96Å; E67-S70 VanDerWaalsContact O-N 3.12Å; E67-S70 PolarHBondContact O-OG 3.35Å
68	N	38.1	Very low	35.7	Very low	135 Å²	135	118.7 Å²	118.7	72%	0.722	64%	0.637	S	S	*	*	H	α-helix	trans	-65	-7.3	175.4	-78.1	-82.4	0	0	0	114.2	E64	E64-N68 WeakPolarHBondContact O-CB 3.43Å; E64-N68 PolarHBondContact O-N 3.34Å; E64-N68 PolarHBondContact O-ND2 2.97Å
69	S	35.1	Very low	35.5	Very low	81 Å²	81	123.2 Å²	123.2	57%	0.566	66%	0.66	S	S	*	*	H	α-helix	trans	-101.4	-14.1	176.3	-61.1	0	0	0	0	113.7	I65 R66 E67	I65-S69 WeakPolarHBondContact O-CB 3.34Å; I65-S69 PolarHBondContact O-N 3.43Å; I65-S69 PolarHBondContact O-OG 3.22Å; R66-S69 PolarHBondContact O-N 3.06Å; R66-S69 VanDerWaalsContact O-N 3.15Å; E67-S69 PolarHBondContact O-N 2.91Å
70	S	33.3	Very low	35.1	Very low	82 Å²	82	125.9 Å²	125.9	57%	0.573	68%	0.676	S	S	*	*	H	α-helix	trans	-86.4	-19.7	-177.2	25.1	0	0	0	0	115.3	R66 E67 F72	R66-S70 PolarHBondContact O-N 3.45Å; R66-S70 PolarHBondContact O-OG 3.06Å; E67-S70 PolarHBondContact O-N 2.96Å; E67-S70 VanDerWaalsContact O-N 3.12Å; E67-S70 PolarHBondContact O-OG 3.35Å; S70-F72 PolarHBondContact O-N 3.44Å
71	E	35.6	Very low	34.8	Very low	177 Å²	177	125.8 Å²	125.8	83%	0.827	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	10	-172.5	-60.6	-161.8	133.6	0	0	115.1
72	F	31.5	Very low	34.4	Very low	195 Å²	195	131.8 Å²	131.8	86%	0.855	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	30	-171.8	-141	-96.3	0	0	0	115.8	S70	S70-F72 PolarHBondContact O-N 3.44Å
73	T	28.7	Very low	34	Very low	133 Å²	133	135.5 Å²	135.5	82%	0.816	73%	0.729	S	S	*	*			trans	-139.6	98.4	173	54.8	0	0	0	0	113.1
74	G	30.3	Very low	33.7	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	74%	0.743	S	S	*	*			trans	155.6	129.1	174.9	0	0	0	0	0	109.9
75	D	31.1	Very low	33.3	Very low	169 Å²	169	138.9 Å²	138.9	90%	0.904	77%	0.766	S	S	*	*			cis	-131	159.6	-0.4	-82.7	-43.5	0	0	0	111.5
76	S	27.8	Very low	32.9	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	78%	0.776	S	S	*	*			trans	-141.9	117.9	168.1	-172.2	0	0	0	0	110.9
77	F	35.8	Very low	32.9	Very low	209 Å²	209	137.3 Å²	137.3	92%	0.917	78%	0.783	S	S	*	*			trans	-137.4	127	163.5	-102.7	-84.9	0	0	0	110.6
78	H	30.5	Very low	32.7	Very low	168 Å²	168	136.5 Å²	136.5	78%	0.778	79%	0.792	S	S	*	*			trans	-77	147.2	178.5	-65.8	-87.7	0	0	0	111.9
79	T	35.9	Very low	32.4	Very low	140 Å²	140	133.3 Å²	133.3	86%	0.859	79%	0.791	S	S	*	*				-158.5	137.6	122.7	6.4	0	0	0	0	114.5
80	T	32.6	Very low	32.4	Very low	138 Å²	138	141.1 Å²	141.1	85%	0.847	81%	0.808	S	S	*	*			trans	-48.6	148.8	173.4	49.7	0	0	0	0	117.5
81	G	32.8	Very low	32.4	Very low	80 Å²	80	145.6 Å²	145.6	83%	0.825	82%	0.817	S	S	*	*			trans	178.3	89.1	163	0	0	0	0	0	118.5
82	K	32.6	Very low	32.6	Very low	186 Å²	186	144.4 Å²	144.4	81%	0.809	82%	0.816	S	S	*	*			trans	-36.4	150.7	171.7	-80.9	171.4	167.7	175.7	0	119.4
83	M	30.7	Very low	32.8	Very low	180 Å²	180	138.4 Å²	138.4	89%	0.887	81%	0.81	S	S	*	*			trans	68.2	148.9	146.2	-68.1	155	157.1	0	0	118.2
84	G	32.7	Very low	33.3	Very low	71 Å²	71	141.8 Å²	141.8	73%	0.732	81%	0.813	S	S	*	*			cis	178.5	158.8	-6.7	0	0	0	0	0	114.2
85	M	31.3	Very low	33.5	Very low	192 Å²	192	144.1 Å²	144.1	95%	0.946	82%	0.816	S	S	*	*			trans	33.4	112.6	163.8	-80.3	-169.4	169.2	0	0	123.1
86	A	31.7	Very low	33.7	Very low	93 Å²	93	143.6 Å²	143.6	77%	0.769	81%	0.809	S	S	*	*				86.1	176	114.8	0	0	0	0	0	122.4
87	I	35.9	Very low	34	Very low	157 Å²	157	145.7 Å²	145.7	81%	0.805	81%	0.813	S	S	*	*			trans	87.6	80.4	174.5	-47	-176	0	0	0	117.4
88	S	31.6	Very low	34	Very low	116 Å²	116	143.3 Å²	143.3	81%	0.811	81%	0.808	S	S	*	*			trans	3.5	146.1	139.6	60.9	0	0	0	0	121.9
89	G	32.5	Very low	34.5	Very low	67 Å²	67	140.9 Å²	140.9	69%	0.691	81%	0.808	S	S	*	*			trans	-177.2	95.6	153.2	0	0	0	0	0	118.4
90	R	35	Very low	34.3	Very low	246 Å²	246	140.4 Å²	140.4	93%	0.928	81%	0.805	S	S	*	*			trans	66.7	168.5	159.2	-54.3	174.6	-172	-174.9	1.7	116.6
91	K	34.6	Very low	34.7	Very low	176 Å²	176	142.6 Å²	142.6	77%	0.765	81%	0.805	S	S	*	*				-177.9	158.9	-55	-121.6	-165	176.9	-165	0	107.3
92	D	38.6	Very low	34.7	Very low	151 Å²	151	147.7 Å²	147.7	81%	0.807	80%	0.804	S	S	*	*			trans	67.7	134.8	165.1	-43.1	-38.8	0	0	0	117
93	G	35.1	Very low	35	Very low	70 Å²	70	149.8 Å²	149.8	72%	0.722	81%	0.807	S	S	*	*			cis	178.7	148.2	-11.3	0	0	0	0	0	115.7
94	K	40.3	Very low	35.3	Very low	203 Å²	203	148.9 Å²	148.9	88%	0.883	80%	0.801	S	S	*	*			trans	63.7	137.5	165.1	-68.8	-170.3	174.2	-173	0	121.1
95	P	33.6	Very low	35.3	Very low	121 Å²	121	155 Å²	155	79%	0.786	80%	0.802	S	S	*	*			trans	-91.5	164.8	158.3	38.3	-33.1	0	0	0	112.3
96	M	35.8	Very low	35.6	Very low	157 Å²	157	153 Å²	153	77%	0.773	79%	0.79	S	S	*	*			trans	-147.9	113.3	172	-82.8	-63.9	-61.9	0	0	113
97	D	34.8	Very low	35.9	Very low	139 Å²	139	154.9 Å²	154.9	74%	0.743	79%	0.786	S	S	*	*			trans	42.5	144.3	136.6	-56.5	-13.7	0	0	0	125.2
98	I	35.5	Very low	36	Very low	158 Å²	158	155.9 Å²	155.9	81%	0.81	79%	0.787	S	S	*	*			trans	-96.7	130	174.8	-59.5	162	0	0	0	110.2
99	P	40.4	Very low	36.3	Very low	118 Å²	118	154.4 Å²	154.4	77%	0.766	78%	0.783	S	S	*	*			trans	-100.1	103.4	173.1	34.5	-29.5	0	0	0	113.1
100	T	32.2	Very low	36.6	Very low	129 Å²	129	156.1 Å²	156.1	79%	0.791	79%	0.79	S	S	*	*			trans	-78.9	137.6	162	54.5	0	0	0	0	110.7
101	H	40.9	Very low	36.7	Very low	184 Å²	184	152.2 Å²	152.2	85%	0.852	78%	0.784	S	S	*	*			trans	-138.5	139.7	173.8	-130.3	-79.9	0	0	0	114.7
102	K	33.5	Very low	37.1	Very low	187 Å²	187	149.1 Å²	149.1	81%	0.813	78%	0.782	S	S	*	*			trans	-100.2	147.2	178.4	-70.3	175.7	176	173	0	112.4
103	R	37.9	Very low	37	Very low	230 Å²	230	147.7 Å²	147.7	87%	0.868	78%	0.779	S	S	*	*			trans	-143.6	133.3	138.1	-72.3	-170.1	171.9	-176.5	-3.1	106
104	Q	36.6	Very low	37.1	Very low	162 Å²	162	149.2 Å²	149.2	76%	0.757	78%	0.784	S	S	*	*				62.4	127.7	54.2	-73.7	-176.5	-40.1	0	0	113.1
105	R	33	Very low	36.8	Very low	199 Å²	199	144.3 Å²	144.3	75%	0.751	78%	0.776	S	S	*	*			cis	-166.8	179.2	-9.4	-144.8	179.1	-172	-178.5	-0.4	108.5
106	E	37.6	Very low	37	Very low	149 Å²	149	146.6 Å²	146.6	70%	0.696	78%	0.776	S	S	*	*			trans	72	145.7	155.2	-76.1	154.9	-127.8	0	0	117.4
107	L	38.9	Very low	37.1	Very low	133 Å²	133	145 Å²	145	70%	0.696	78%	0.777	S	S	*	*			cis	-147.7	151.2	-4.8	-81.9	126.1	0	0	0	110.5
108	H	37.6	Very low	37.1	Very low	178 Å²	178	141.9 Å²	141.9	82%	0.824	78%	0.778	S	S	*	*			trans	51.2	153.7	144.3	-70.9	-132.4	0	0	0	121.7
109	A	38.2	Very low	37.1	Very low	86 Å²	86	138.9 Å²	138.9	71%	0.711	78%	0.777	S	S	*	*			cis	-170.6	170.6	-21.7	0	0	0	0	0	110.3
110	A	38.5	Very low	36.8	Very low	102 Å²	102	140.8 Å²	140.8	84%	0.843	78%	0.78	S	S	*	*			trans	81.5	137.1	163.5	0	0	0	0	0	121.4
111	M	37.2	Very low	37	Very low	164 Å²	164	140.2 Å²	140.2	81%	0.808	78%	0.776	S	S	*	*			trans	-112.5	-166.7	169.1	-71.6	179.3	66.3	0	0	107.3
112	P	42.5	Very low	36.5	Very low	111 Å²	111	137.9 Å²	137.9	72%	0.721	77%	0.77	S	S	*	*			cis	-146.9	169.9	8.8	44.6	-23.9	0	0	0	120.2
113	V	36.2	Very low	36.5	Very low	122 Å²	122	135.6 Å²	135.6	74%	0.739	77%	0.771	S	S	*	*			trans	21.8	131.7	137.7	-173.2	0	0	0	0	120.7
114	A	37.6	Very low	36.1	Very low	101 Å²	101	133 Å²	133	84%	0.835	77%	0.769	S	S	*	*			trans	-141.8	148.1	146	0	0	0	0	0	110.4
115	S	35.2	Very low	36.1	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	78%	0.775	S	S	*	*			trans	-158.7	131.1	-179	-179.9	0	0	0	0	111.3
116	Q	37.8	Very low	35.9	Very low	168 Å²	168	127.8 Å²	127.8	79%	0.785	78%	0.775	S	S	*	*			trans	45.4	139.5	149.7	-62.6	-61.1	-21.4	0	0	119.7
117	P	38	Very low	35.6	Very low	124 Å²	124	129.8 Å²	129.8	81%	0.805	78%	0.782	S	S	*	*				-148.1	-171.1	59.9	40.4	-20	0	0	0	115.2
118	G	33	Very low	35.1	Very low	73 Å²	73	130.7 Å²	130.7	75%	0.753	79%	0.787	S	S	*	*			trans	-136.3	168.4	172.2	0	0	0	0	0	113.3
119	A	36.4	Very low	34.8	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	79%	0.787	S	S	*	*			trans	-160.1	121	172.9	0	0	0	0	0	114
120	N	34.7	Very low	34.3	Very low	157 Å²	157	136.3 Å²	136.3	84%	0.84	80%	0.796	S	S	*	*			trans	58	133.8	132.6	-82.6	2.6	0	0	0	125.7
121	V	34.7	Very low	33.8	Very low	117 Å²	117	135.7 Å²	135.7	71%	0.709	79%	0.791	S	S	*	*			trans	98.7	111.6	131.7	166.9	0	0	0	0	121.1
122	L	30.4	Very low	33.6	Very low	136 Å²	136	136.1 Å²	136.1	71%	0.712	80%	0.796	S	S	*	*			trans	13.4	137.6	146.5	-62.5	123.8	0	0	0	121.3
123	T	34.8	Very low	32.8	Very low	138 Å²	138	142.6 Å²	142.6	85%	0.847	81%	0.806	S	S	*	*				-170.3	168.4	95.2	20.9	0	0	0	0	113
124	H	30	Very low	32.4	Very low	175 Å²	175	142.2 Å²	142.2	81%	0.81	81%	0.809	S	S	*	*			trans	-79.3	145.4	179.8	-61	-116.8	0	0	0	112.8
125	T	36	Very low	32.2	Very low	144 Å²	144	146.2 Å²	146.2	88%	0.883	81%	0.807	S	S	*	*			trans	-144.1	138.5	136.7	39.9	0	0	0	0	110.7
126	S	28.6	Very low	32	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	81%	0.806	S	S	*	*			trans	-83.4	147.4	168.6	51.1	0	0	0	0	110.8
127	F	31.5	Very low	31.4	Very low	191 Å²	191	150.7 Å²	150.7	84%	0.838	81%	0.813	S	S	*	*			trans	-144.7	92.4	161.4	-134.5	-81.8	0	0	0	111.7
128	D	28.2	Very low	31.2	Very low	153 Å²	153	150.5 Å²	150.5	82%	0.818	82%	0.815	S	S	*	*			trans	-70.6	126.4	155.2	-86.8	-66.1	0	0	0	108.5
129	E	30.3	Very low	31.1	Very low	174 Å²	174	156.1 Å²	156.1	81%	0.813	82%	0.819	S	S	*	*			trans	-156.5	157.6	132.4	-122.4	-171.6	152.9	0	0	114.8
130	K	28.4	Very low	30.6	Very low	208 Å²	208	162.7 Å²	162.7	90%	0.904	82%	0.823	S	S	*	*			trans	-87.1	115.4	-167.7	-62.8	151	-175.7	158.7	0	111.1
131	A	29	Very low	30.3	Very low	89 Å²	89	160.8 Å²	160.8	74%	0.736	81%	0.813	S	S	*	*			trans	-141.7	158.4	164.8	0	0	0	0	0	112.1
132	L	31.6	Very low	30.4	Very low	173 Å²	173	160.3 Å²	160.3	91%	0.906	81%	0.81	S	S	*	*			trans	60.6	51.9	166.8	-60.7	166.1	0	0	0	117
133	R	26.1	Very low	30.5	Very low	246 Å²	246	164 Å²	164	93%	0.928	81%	0.814	S	S	*	*			trans	-69.6	149.9	138.3	-94.5	-171.1	170.3	-139.3	-1.5	109.4
134	S	27	Very low	30.5	Very low	115 Å²	115	161.2 Å²	161.2	80%	0.804	80%	0.801	S	S	*	*			trans	77.4	92.8	174.8	-158.8	0	0	0	0	116.6
135	K	34.9	Very low	30.7	Very low	184 Å²	184	162.9 Å²	162.9	80%	0.8	80%	0.8	S	S	*	*				-157.5	170.7	125.5	-106.4	-175.2	178.6	-175.4	0	111.6
136	E	30.2	Very low	30.9	Very low	148 Å²	148	159 Å²	159	69%	0.692	78%	0.779	S	S	*	*			trans	-36.3	134.4	-166.2	-64.7	92.6	164.8	0	0	116
137	K	26.4	Very low	31.2	Very low	215 Å²	215	159.7 Å²	159.7	94%	0.935	77%	0.774	S	S	*	*			cis	53.7	62.4	44.9	-74.6	-167.8	176.1	-179.9	0	114.9
138	S	33.3	Very low	31.5	Very low	120 Å²	120	153.4 Å²	153.4	84%	0.839	76%	0.758	S	S	*	*			trans	-117.5	153.2	153.2	60.3	0	0	0	0	110
139	K	30.1	Very low	32.1	Very low	192 Å²	192	148.5 Å²	148.5	84%	0.835	74%	0.738	S	S	*	*			trans	-132.3	108.1	-152.4	-175.2	-177.5	179.6	-175.7	0	113.6
140	W	26.6	Very low	32.5	Very low	233 Å²	233	144.7 Å²	144.7	88%	0.883	72%	0.723	S	S	*	*			trans	37.8	92.4	149.3	-75.9	61.8	0	0	0	117.4	V142	W140-V142 HydrophobicContact CE3-CG2 4.24Å
141	D	27.8	Very low	33.1	Very low	118 Å²	118	142 Å²	142	63%	0.631	71%	0.712	S	S	*	*			trans	-120.8	77.7	160.2	-168.8	-0.2	0	0	0	111	R143 S144	D141-R143 PolarHBondContact OD1-N 2.99Å; D141-S144 PolarHBondContact OD1-OG 2.89Å
142	V	36.8	Very low	33.6	Very low	106 Å²	106	142.8 Å²	142.8	64%	0.642	70%	0.703	S	S	*	*			trans	-90.3	-10.1	176.1	-179.3	0	0	0	0	111	W140 S144	W140-V142 HydrophobicContact CE3-CG2 4.24Å; V142-S144 PolarHBondContact O-N 3.18Å
143	R	32.6	Very low	34	Very low	213 Å²	213	139.5 Å²	139.5	80%	0.804	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-10	-164.2	-148	169.3	-172.4	169.9	-0.9	114.1	D141 S146	D141-R143 PolarHBondContact OD1-N 2.99Å; R143-S146 PolarHBondContact O-OG 3.21Å
144	S	35.3	Very low	34.8	Very low	81 Å²	81	133.9 Å²	133.9	57%	0.566	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	4.9	-176.4	-57.4	0	0	0	0	114.3	D141 V142	D141-S144 PolarHBondContact OD1-OG 2.89Å; V142-S144 PolarHBondContact O-N 3.18Å
145	R	34.9	Very low	35.3	Very low	210 Å²	210	134.4 Å²	134.4	79%	0.792	66%	0.656	S	S	*	*	S	Bend	trans	-111.3	-18.9	-178.5	-63.4	-179	80	164.8	2.9	114.8
146	S	38.2	Very low	35.5	Very low	63 Å²	63	132.8 Å²	132.8	44%	0.441	65%	0.649	S	S	.	*	H	α-helix	trans	-65.2	-48.6	172.1	42	0	0	0	0	111.7	R143 A148 A149 D150	R143-S146 PolarHBondContact O-OG 3.21Å; S146-A148 VanDerWaalsContact C-N 3.27Å; S146-A148 PolarHBondContact O-N 2.98Å; S146-A149 WeakPolarHBondContact O-CB 3.45Å; S146-A149 PolarHBondContact O-N 2.87Å; S146-D150 PolarHBondContact O-N 3.47Å
147	D	35.4	Very low	36	Very low	122 Å²	122	134.2 Å²	134.2	65%	0.652	65%	0.649	S	S	*	*	H	α-helix	trans	-76.1	-20.1	-167.1	-59.8	24.2	0	0	0	111.7
148	A	39	Very low	36.5	Very low	59 Å²	59	127.9 Å²	127.9	49%	0.488	64%	0.638	S	S	.	*	H	α-helix	trans	-75.3	-36	168	0	0	0	0	0	112.4	S146 L152	S146-A148 VanDerWaalsContact C-N 3.27Å; S146-A148 PolarHBondContact O-N 2.98Å; A148-L152 PolarHBondContact O-N 3.43Å
149	A	39.7	Very low	36.5	Very low	50 Å²	50	127.4 Å²	127.4	41%	0.413	63%	0.626	S	S	.	*	H	α-helix	trans	-71.4	-43.3	177.4	0	0	0	0	0	111.7	S146 K151 L152 M153	S146-A149 WeakPolarHBondContact O-CB 3.45Å; S146-A149 PolarHBondContact O-N 2.87Å; A149-K151 PolarHBondContact O-N 3.25Å; A149-K151 VanDerWaalsContact O-N 3.11Å; A149-L152 PolarHBondContact O-N 2.97Å; A149-M153 WeakPolarHBondContact O-CB 3.39Å; A149-M153 WeakPolarHBondContact O-CG 3.28Å; A149-M153 PolarHBondContact O-N 2.95Å
150	D	38.9	Very low	36.7	Very low	93 Å²	93	126.5 Å²	126.5	50%	0.497	62%	0.624	S	S	.	*	H	α-helix	trans	-66.2	-13.8	179	-166.2	54.2	0	0	0	113.6	S146 K154	S146-D150 PolarHBondContact O-N 3.47Å; D150-K154 PolarHBondContact O-NZ 3.46Å; D150-K154 IonicContact OD1-NZ 3.72Å; D150-K154 PolarHBondContact OD1-NZ 2.88Å; D150-K154 IonicContact OD2-NZ 3.95Å; D150-K154 PolarHBondContact OD2-NZ 3.43Å
151	K	42.1	Very low	36.9	Very low	152 Å²	152	124 Å²	124	66%	0.661	63%	0.628	S	S	*	*	H	α-helix	trans	-88	-48.5	172.4	-153.3	177	-176.1	-171.9	0	112.2	A149 M153 K154	A149-K151 PolarHBondContact O-N 3.25Å; A149-K151 VanDerWaalsContact O-N 3.11Å; K151-M153 VanDerWaalsContact C-N 3.25Å; K151-M153 PolarHBondContact O-N 2.86Å; K151-K154 PolarHBondContact O-N 3.4Å; K151-K154 VanDerWaalsContact O-N 3.1Å
152	L	38.6	Very low	37	Very low	105 Å²	105	123.2 Å²	123.2	55%	0.55	63%	0.632	S	S	.	*	H	α-helix	trans	-61.9	-31.3	174.3	-96	161	0	0	0	113.2	A148 A149 K154 K156	A148-L152 PolarHBondContact O-N 3.43Å; A149-L152 PolarHBondContact O-N 2.97Å; L152-K154 PolarHBondContact O-N 3.31Å; L152-K156 PolarHBondContact O-N 3.46Å
153	M	40	Very low	36.6	Very low	104 Å²	104	123.4 Å²	123.4	51%	0.512	64%	0.638	S	S	.	*	H	α-helix	trans	-77.2	8.1	175.6	-67.3	-70.5	-74.6	0	0	113.9	A149 K151 Y157	A149-M153 WeakPolarHBondContact O-CB 3.39Å; A149-M153 WeakPolarHBondContact O-CG 3.28Å; A149-M153 PolarHBondContact O-N 2.95Å; K151-M153 VanDerWaalsContact C-N 3.25Å; K151-M153 PolarHBondContact O-N 2.86Å; M153-Y157 HydrophobicContact CE-CE2 3.76Å; M153-Y157 VanDerWaalsContact O-CD2 3.26Å; M153-Y157 WeakPolarHBondContact O-CD2 3.26Å; M153-Y157 HydrophobicContact SD-CE2 4.15Å
154	K	42	Very low	36.8	Very low	128 Å²	128	119.1 Å²	119.1	56%	0.557	64%	0.641	S	S	*	*	H	α-helix	trans	-114.9	-26.9	172.3	-70.8	-175.9	-177.6	76.3	0	114	D150 K151 L152	D150-K154 PolarHBondContact O-NZ 3.46Å; D150-K154 IonicContact OD1-NZ 3.72Å; D150-K154 PolarHBondContact OD1-NZ 2.88Å; D150-K154 IonicContact OD2-NZ 3.95Å; D150-K154 PolarHBondContact OD2-NZ 3.43Å; K151-K154 PolarHBondContact O-N 3.4Å; K151-K154 VanDerWaalsContact O-N 3.1Å; L152-K154 PolarHBondContact O-N 3.31Å
155	E	38.1	Very low	36.7	Very low	127 Å²	127	121 Å²	121	59%	0.593	65%	0.649	S	S	*	*	H	α-helix	trans	-75.4	-35.4	172.1	-69.7	167.3	154.2	0	0	110.9	Y157	E155-Y157 VanDerWaalsContact C-N 3.35Å; E155-Y157 PolarHBondContact O-N 3.1Å
156	K	40.1	Very low	36.5	Very low	149 Å²	149	116.4 Å²	116.4	65%	0.648	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-5.5	-176.9	-77.6	-157.3	167.2	-155.8	0	117.7	L152	L152-K156 PolarHBondContact O-N 3.46Å
157	Y	40.1	Very low	35.9	Very low	178 Å²	178	124.2 Å²	124.2	70%	0.698	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	17	-178.4	-74.9	-89.5	0	0	0	113.3	M153 E155	M153-Y157 HydrophobicContact CE-CE2 3.76Å; M153-Y157 VanDerWaalsContact O-CD2 3.26Å; M153-Y157 WeakPolarHBondContact O-CD2 3.26Å; M153-Y157 HydrophobicContact SD-CE2 4.15Å; E155-Y157 VanDerWaalsContact C-N 3.35Å; E155-Y157 PolarHBondContact O-N 3.1Å
158	A	37.5	Very low	35.7	Very low	83 Å²	83	124.4 Å²	124.4	69%	0.686	67%	0.671	S	S	*	*	S	Bend	trans	-115.1	-13.2	179.9	0	0	0	0	0	114.7
159	D	33.2	Very low	35.1	Very low	110 Å²	110	126.4 Å²	126.4	59%	0.588	69%	0.687	S	S	*	*	S	Bend	trans	-104	-14.6	-164.5	-70	-29.2	0	0	0	115.6	D161 S162	D159-D161 PolarHBondContact O-N 3.22Å; D159-S162 PolarHBondContact O-N 2.83Å; D159-S162 PolarHBondContact O-OG 2.93Å
160	E	33.7	Very low	34.5	Very low	173 Å²	173	128.2 Å²	128.2	81%	0.808	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-12.1	-163.8	-64.6	-162.2	148.2	0	0	116.1	S162	E160-S162 PolarHBondContact O-N 3.3Å
161	D	32.1	Very low	34.1	Very low	179 Å²	179	130.8 Å²	130.8	96%	0.957	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	7	174.6	-79.2	-44.4	0	0	0	113.9	D159	D159-D161 PolarHBondContact O-N 3.22Å
162	S	29	Very low	33.4	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	72%	0.721	S	S	*	*			trans	-112.6	32.7	-168.3	70.5	0	0	0	0	116.3	D159 E160	D159-S162 PolarHBondContact O-N 2.83Å; D159-S162 PolarHBondContact O-OG 2.93Å; E160-S162 PolarHBondContact O-N 3.3Å
163	S	29.2	Very low	33	Very low	110 Å²	110	130.5 Å²	130.5	77%	0.769	74%	0.739	S	S	*	*			trans	-132.4	92.4	176	62.8	0	0	0	0	116
164	S	35.7	Very low	32.5	Very low	124 Å²	124	129 Å²	129	87%	0.867	75%	0.75	S	S	*	*			trans	-133.6	150.8	153	73.5	0	0	0	0	110
165	T	32.9	Very low	31.8	Very low	120 Å²	120	129.9 Å²	129.9	74%	0.736	77%	0.766	S	S	*	*			trans	-119.1	148.7	-144.4	-19.6	0	0	0	0	115.5
166	N	30.3	Very low	31.6	Very low	114 Å²	114	130.4 Å²	130.4	61%	0.61	78%	0.778	S	S	*	*			trans	77.7	125.6	154.1	-73.1	-24.1	0	0	0	121.4
167	W	25.9	Very low	31.1	Very low	227 Å²	227	132.8 Å²	132.8	86%	0.86	79%	0.789	S	S	*	*			trans	56	106.1	132.8	-56.6	-8.9	0	0	0	119.2
168	S	30.8	Very low	30.6	Very low	126 Å²	126	134.3 Å²	134.3	88%	0.881	80%	0.799	S	S	*	*				-167.9	152.7	92.4	-77.3	0	0	0	0	111.4
169	A	26.6	Very low	30.4	Very low	100 Å²	100	138.9 Å²	138.9	83%	0.826	80%	0.804	S	S	*	*			trans	-98.2	140.2	173.1	0	0	0	0	0	110.6
170	A	27.7	Very low	30.3	Very low	88 Å²	88	141.6 Å²	141.6	73%	0.727	82%	0.818	S	S	*	*				171.2	147.8	126.3	0	0	0	0	0	113.8
171	T	30.7	Very low	30.4	Very low	147 Å²	147	138.6 Å²	138.6	90%	0.902	81%	0.808	S	S	*	*			trans	74.2	149.3	159.3	-10	0	0	0	0	117.9
172	A	28	Very low	30.5	Very low	79 Å²	79	136.7 Å²	136.7	65%	0.653	80%	0.798	S	S	*	*			trans	-123.7	-177.3	-174.3	0	0	0	0	0	111.7
173	N	29.2	Very low	31.2	Very low	172 Å²	172	138.8 Å²	138.8	92%	0.92	80%	0.8	S	S	*	*			trans	85.6	121.2	175.9	-48	-36.4	0	0	0	115.1
174	G	30.8	Very low	32	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	79%	0.789	S	S	*	*			trans	168.2	46.7	-177.6	0	0	0	0	0	114.1	T176	G174-T176 PolarHBondContact O-N 2.87Å
175	T	27.2	Very low	32.8	Very low	148 Å²	148	138.7 Å²	138.7	91%	0.908	78%	0.781	S	S	*	*			trans	-77.2	115.8	-174.9	7.5	0	0	0	0	113.2
176	T	33.4	Very low	34.2	Very low	138 Å²	138	137.5 Å²	137.5	85%	0.847	77%	0.774	S	S	*	*			trans	-130	138.5	160.7	38.9	0	0	0	0	110.6	G174	G174-T176 PolarHBondContact O-N 2.87Å
177	K	28.6	Very low	35.1	Very low	198 Å²	198	137.7 Å²	137.7	86%	0.861	77%	0.771	S	S	*	*			trans	-94.9	139.6	-178.1	-62.2	175.8	179.2	177.9	0	110.6
178	F	30.7	Very low	36.3	Very low	211 Å²	211	132.6 Å²	132.6	93%	0.925	76%	0.758	S	S	*	*			trans	-116.6	153.7	147	-94.7	-92.9	0	0	0	109.5
179	K	33.3	Very low	37.7	Very low	178 Å²	178	130.3 Å²	130.3	77%	0.774	74%	0.742	S	S	*	*			trans	-97.1	132.9	-177.2	-64.9	178	178.8	179.4	0	109.5
180	N	30.4	Very low	39.4	Very low	167 Å²	167	130.8 Å²	130.8	89%	0.893	73%	0.727	S	S	*	*			trans	-82.8	135.3	154	-68.4	2.4	0	0	0	107.8
181	N	37	Very low	40.8	Very low	110 Å²	110	130.7 Å²	130.7	59%	0.588	71%	0.714	S	S	*	*			trans	-124.7	123.1	169.5	-99.3	83	0	0	0	107.6
182	D	32.7	Very low	42.3	Very low	140 Å²	140	130.1 Å²	130.1	75%	0.749	70%	0.699	S	S	*	*			trans	59.2	80.6	142.4	-37.3	-32.7	0	0	0	118.2
183	L	44.4	Very low	44	Very low	145 Å²	145	134 Å²	134	76%	0.759	70%	0.697	S	S	*	*			trans	-105.7	138.3	138.5	-88	89.9	0	0	0	108.6
184	D	46.1	Very low	45	Very low	100 Å²	100	130.2 Å²	130.2	54%	0.535	67%	0.673	S	S	.	*			trans	-81.8	134.9	-171	-172.4	53.2	0	0	0	112.3	T186 Q187	D184-T186 PolarHBondContact O-N 3.39Å; D184-T186 WeakPolarHBondContact OD2-CB 3.05Å; D184-T186 PolarHBondContact OD2-OG1 2.7Å; D184-Q187 PolarHBondContact O-N 2.69Å
185	D	51.8	Low	45.9	Very low	133 Å²	133	132.9 Å²	132.9	71%	0.711	67%	0.668	S	S	*	*	H	α-helix	trans	-56.9	-25.7	-175.8	-83.7	-42.9	0	0	0	112.9	Q187 M188 S189	D185-Q187 VanDerWaalsContact C-N 3.33Å; D185-Q187 PolarHBondContact O-N 2.94Å; D185-M188 PolarHBondContact O-N 3.35Å; D185-S189 WeakPolarHBondContact O-CB 3.45Å; D185-S189 PolarHBondContact O-N 3.03Å; D185-S189 PolarHBondContact O-OG 2.83Å
186	T	62.5	Low	47.1	Very low	95 Å²	95	129.8 Å²	129.8	58%	0.583	64%	0.643	S	S	*	*	H	α-helix	trans	-59.3	-41.5	174	-40.2	0	0	0	0	111.9	D184 S189 Q190	D184-T186 PolarHBondContact O-N 3.39Å; D184-T186 WeakPolarHBondContact OD2-CB 3.05Å; D184-T186 PolarHBondContact OD2-OG1 2.7Å; T186-S189 WeakPolarHBondContact O-CB 3.41Å; T186-S189 PolarHBondContact O-N 2.82Å; T186-Q190 PolarHBondContact O-N 3.46Å
187	Q	50.1	Low	48	Very low	118 Å²	118	125 Å²	125	55%	0.551	62%	0.615	S	S	*	*	H	α-helix	trans	-74.1	-39.9	-178.7	-66.5	-170.2	-18.6	0	0	112	D184 D185 S189 Q190 I191	D184-Q187 PolarHBondContact O-N 2.69Å; D185-Q187 VanDerWaalsContact C-N 3.33Å; D185-Q187 PolarHBondContact O-N 2.94Å; Q187-S189 PolarHBondContact O-N 3.48Å; Q187-Q190 WeakPolarHBondContact O-CB 3.43Å; Q187-Q190 PolarHBondContact O-N 3.02Å; Q187-I191 WeakPolarHBondContact O-CG1 3.23Å; Q187-I191 PolarHBondContact O-N 3.4Å
188	M	50.1	Low	48.6	Very low	120 Å²	120	119.4 Å²	119.4	59%	0.591	60%	0.598	S	S	*	*	H	α-helix	trans	-61.5	-35.7	172.2	-76.6	-67	-71.4	0	0	112	D185 K192	D185-M188 PolarHBondContact O-N 3.35Å; M188-K192 VanDerWaalsContact O-CB 3.29Å; M188-K192 WeakPolarHBondContact O-CB 3.35Å; M188-K192 PolarHBondContact O-N 2.74Å; M188-K192 VanDerWaalsContact O-N 3.1Å
189	S	60.4	Low	49.6	Very low	78 Å²	78	113.8 Å²	113.8	55%	0.545	58%	0.581	S	S	.	*	H	α-helix	trans	-67.6	-41.4	175.1	-59.4	0	0	0	0	112.4	D185 T186 Q187 W193	D185-S189 WeakPolarHBondContact O-CB 3.45Å; D185-S189 PolarHBondContact O-N 3.03Å; D185-S189 PolarHBondContact O-OG 2.83Å; T186-S189 WeakPolarHBondContact O-CB 3.41Å; T186-S189 PolarHBondContact O-N 2.82Å; Q187-S189 PolarHBondContact O-N 3.48Å; S189-W193 PolarHBondContact O-N 3.22Å
190	Q	61.6	Low	49.9	Very low	109 Å²	109	111.6 Å²	111.6	51%	0.509	57%	0.568	S	S	.	*	H	α-helix	trans	-60.8	-54.5	175.2	-173.5	81.9	24.5	0	0	111.3	T186 Q187 K192 W193 E194	T186-Q190 PolarHBondContact O-N 3.46Å; Q187-Q190 WeakPolarHBondContact O-CB 3.43Å; Q187-Q190 PolarHBondContact O-N 3.02Å; Q190-K192 VanDerWaalsContact C-N 3.3Å; Q190-K192 PolarHBondContact O-N 3.4Å; Q190-W193 WeakPolarHBondContact O-CB 3.45Å; Q190-W193 PolarHBondContact O-N 3.21Å; Q190-E194 WeakPolarHBondContact CG-OE1 3.35Å; Q190-E194 PolarHBondContact NE2-OE1 2.98Å; Q190-E194 PolarHBondContact O-N 3.31Å
191	I	57.7	Low	50.1	Low	86 Å²	86	109.9 Å²	109.9	44%	0.441	56%	0.555	S	S	.	*	H	α-helix	trans	-58.7	-42.2	-179.2	-66.7	163.8	0	0	0	110.9	Q187 W193 E194 M195	Q187-I191 WeakPolarHBondContact O-CG1 3.23Å; Q187-I191 PolarHBondContact O-N 3.4Å; I191-W193 PolarHBondContact O-N 3.38Å; I191-E194 PolarHBondContact O-N 3.39Å; I191-M195 HydrophobicContact CG2-CE 4.45Å; I191-M195 PolarHBondContact O-N 2.97Å
192	K	61.5	Low	50.2	Low	136 Å²	136	111.5 Å²	111.5	59%	0.591	56%	0.56	S	S	*	*	H	α-helix	trans	-63.7	-40.1	176.6	-174.3	177.8	177.1	-176.8	0	112.3	M188 Q190 E194 E196	M188-K192 VanDerWaalsContact O-CB 3.29Å; M188-K192 WeakPolarHBondContact O-CB 3.35Å; M188-K192 PolarHBondContact O-N 2.74Å; M188-K192 VanDerWaalsContact O-N 3.1Å; Q190-K192 VanDerWaalsContact C-N 3.3Å; Q190-K192 PolarHBondContact O-N 3.4Å; K192-E194 VanDerWaalsContact C-N 3.34Å; K192-E196 WeakPolarHBondContact CE-OE1 3.42Å; K192-E196 WeakPolarHBondContact O-CB 3.33Å; K192-E196 WeakPolarHBondContact O-CG 3.23Å; K192-E196 PolarHBondContact O-N 3.03Å
193	W	64.6	Low	50.5	Low	161 Å²	161	107.2 Å²	107.2	61%	0.61	54%	0.541	S	S	*	.	H	α-helix	trans	-65.6	-37	176.7	-173.1	93.8	0	0	0	112.2	S189 Q190 I191 E196 S197	S189-W193 PolarHBondContact O-N 3.22Å; Q190-W193 WeakPolarHBondContact O-CB 3.45Å; Q190-W193 PolarHBondContact O-N 3.21Å; I191-W193 PolarHBondContact O-N 3.38Å; W193-E196 PolarHBondContact O-N 3.47Å; W193-S197 VanDerWaalsContact O-CB 3.3Å; W193-S197 WeakPolarHBondContact O-CB 3.31Å; W193-S197 PolarHBondContact O-N 3.19Å; W193-S197 PolarHBondContact O-OG 2.97Å
194	E	50.3	Low	50.4	Low	91 Å²	91	104.6 Å²	104.6	43%	0.425	53%	0.528	S	S	.	.	H	α-helix	trans	-71.1	-39.7	177.7	-69.6	172.4	-168.2	0	0	112.3	Q190 I191 K192 S197 T198	Q190-E194 WeakPolarHBondContact CG-OE1 3.35Å; Q190-E194 PolarHBondContact NE2-OE1 2.98Å; Q190-E194 PolarHBondContact O-N 3.31Å; I191-E194 PolarHBondContact O-N 3.39Å; K192-E194 VanDerWaalsContact C-N 3.34Å; E194-S197 PolarHBondContact O-N 2.94Å; E194-S197 PolarHBondContact O-OG 2.86Å; E194-S197 VanDerWaalsContact O-OG 3.1Å; E194-T198 WeakPolarHBondContact O-CG2 3.39Å; E194-T198 PolarHBondContact O-N 3.01Å; E194-T198 VanDerWaalsContact O-N 3.12Å; E194-T198 PolarHBondContact O-OG1 3.29Å
195	M	49.9	Very low	49.9	Very low	129 Å²	129	103.1 Å²	103.1	64%	0.635	53%	0.525	S	S	*	.	H	α-helix	trans	-66.4	-38.3	170.6	-72.7	-169.3	172.1	0	0	112.8	I191 T198 T199	I191-M195 HydrophobicContact CG2-CE 4.45Å; I191-M195 PolarHBondContact O-N 2.97Å; M195-T198 PolarHBondContact O-OG1 3Å; M195-T198 VanDerWaalsContact O-OG1 3.09Å; M195-T199 WeakPolarHBondContact O-CB 3.47Å; M195-T199 PolarHBondContact O-N 3.42Å; M195-T199 PolarHBondContact O-OG1 2.84Å
196	E	53.1	Low	49.1	Very low	82 Å²	82	105.6 Å²	105.6	38%	0.383	52%	0.524	S	S	.	.	H	α-helix	trans	-68	-38.9	174.3	-82.3	-169.3	-150.4	0	0	112.4	K192 W193 R200	K192-E196 WeakPolarHBondContact CE-OE1 3.42Å; K192-E196 WeakPolarHBondContact O-CB 3.33Å; K192-E196 WeakPolarHBondContact O-CG 3.23Å; K192-E196 PolarHBondContact O-N 3.03Å; W193-E196 PolarHBondContact O-N 3.47Å; E196-R200 WeakPolarHBondContact O-CB 3.19Å; E196-R200 PolarHBondContact O-N 3.18Å; E196-R200 IonicContact OE2-CZ 2.73Å; E196-R200 IonicContact OE2-NH2 2.74Å; E196-R200 PolarHBondContact OE2-NH2 3.17Å
197	S	52	Low	47.9	Very low	37 Å²	37	106.8 Å²	106.8	26%	0.259	52%	0.521	S	S	.	.	H	α-helix	trans	-71.5	-43	-176.5	72.3	0	0	0	0	112.3	W193 E194 R200 H201	W193-S197 VanDerWaalsContact O-CB 3.3Å; W193-S197 WeakPolarHBondContact O-CB 3.31Å; W193-S197 PolarHBondContact O-N 3.19Å; W193-S197 PolarHBondContact O-OG 2.97Å; E194-S197 PolarHBondContact O-N 2.94Å; E194-S197 PolarHBondContact O-OG 2.86Å; E194-S197 VanDerWaalsContact O-OG 3.1Å; S197-R200 PolarHBondContact O-N 3.32Å; S197-H201 WeakPolarHBondContact O-CB 3.28Å; S197-H201 PolarHBondContact O-N 3.39Å
198	T	41	Very low	47.5	Very low	82 Å²	82	106.2 Å²	106.2	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-48.4	173.4	47.1	0	0	0	0	111.7	E194 M195 R200 H201 M202	E194-T198 WeakPolarHBondContact O-CG2 3.39Å; E194-T198 PolarHBondContact O-N 3.01Å; E194-T198 VanDerWaalsContact O-N 3.12Å; E194-T198 PolarHBondContact O-OG1 3.29Å; M195-T198 PolarHBondContact O-OG1 3Å; M195-T198 VanDerWaalsContact O-OG1 3.09Å; T198-R200 VanDerWaalsContact C-N 3.29Å; T198-R200 PolarHBondContact O-N 3.23Å; T198-H201 WeakPolarHBondContact O-CB 3.37Å; T198-H201 PolarHBondContact O-N 3.3Å; T198-H201 VanDerWaalsContact O-N 3.14Å; T198-M202 WeakPolarHBondContact O-CG 3.34Å; T198-M202 PolarHBondContact O-N 3.08Å
199	T	50.9	Low	46.8	Very low	93 Å²	93	103.2 Å²	103.2	57%	0.571	51%	0.513	S	S	*	.	H	α-helix	trans	-57.3	-41.8	174.6	-58.4	0	0	0	0	112	M195 S203	M195-T199 WeakPolarHBondContact O-CB 3.47Å; M195-T199 PolarHBondContact O-N 3.42Å; M195-T199 PolarHBondContact O-OG1 2.84Å; T199-S203 WeakPolarHBondContact O-CB 3.1Å; T199-S203 PolarHBondContact O-N 3.46Å
200	R	39.5	Very low	45.8	Very low	131 Å²	131	105.7 Å²	105.7	49%	0.494	52%	0.515	S	S	.	.	H	α-helix	trans	-68.8	-34.3	178.5	-165.6	174.7	-64.9	141.6	3.7	111.9	E196 S197 T198 N204	E196-R200 WeakPolarHBondContact O-CB 3.19Å; E196-R200 PolarHBondContact O-N 3.18Å; E196-R200 IonicContact OE2-CZ 2.73Å; E196-R200 IonicContact OE2-NH2 2.74Å; E196-R200 PolarHBondContact OE2-NH2 3.17Å; S197-R200 PolarHBondContact O-N 3.32Å; T198-R200 VanDerWaalsContact C-N 3.29Å; T198-R200 PolarHBondContact O-N 3.23Å; R200-N204 PolarHBondContact O-N 3.37Å
201	H	36	Very low	44.6	Very low	132 Å²	132	109.3 Å²	109.3	61%	0.611	52%	0.524	S	S	*	.	H	α-helix	trans	-67.6	-51.4	173.8	-161.8	93.3	0	0	0	111.7	S197 T198 S203 N204 C205	S197-H201 WeakPolarHBondContact O-CB 3.28Å; S197-H201 PolarHBondContact O-N 3.39Å; T198-H201 WeakPolarHBondContact O-CB 3.37Å; T198-H201 PolarHBondContact O-N 3.3Å; T198-H201 VanDerWaalsContact O-N 3.14Å; H201-S203 VanDerWaalsContact C-N 3.27Å; H201-S203 PolarHBondContact O-N 2.94Å; H201-N204 PolarHBondContact O-N 3.1Å; H201-C205 PolarHBondContact O-N 2.98Å
202	M	38.2	Very low	43.8	Very low	144 Å²	144	112.1 Å²	112.1	71%	0.709	54%	0.536	S	S	*	.	H	α-helix	trans	-57.8	-39.4	176.4	-65.8	-176.8	83.7	0	0	112.2	T198 N204 C205 R206	T198-M202 WeakPolarHBondContact O-CG 3.34Å; T198-M202 PolarHBondContact O-N 3.08Å; M202-N204 VanDerWaalsContact C-N 3.31Å; M202-N204 PolarHBondContact O-N 3.3Å; M202-C205 PolarHBondContact O-N 2.87Å; M202-R206 WeakPolarHBondContact O-CB 3.42Å; M202-R206 PolarHBondContact O-N 3.35Å; M202-R206 VanDerWaalsContact O-N 3.08Å
203	S	39.8	Very low	42.9	Very low	50 Å²	50	109.6 Å²	109.6	35%	0.35	53%	0.528	S	S	.	.	H	α-helix	trans	-59.7	-39.6	174.6	-168.3	0	0	0	0	112.6	T199 H201 K207	T199-S203 WeakPolarHBondContact O-CB 3.1Å; T199-S203 PolarHBondContact O-N 3.46Å; H201-S203 VanDerWaalsContact C-N 3.27Å; H201-S203 PolarHBondContact O-N 2.94Å; S203-K207 WeakPolarHBondContact O-CD 3.47Å; S203-K207 VanDerWaalsContact O-CG 3.24Å; S203-K207 WeakPolarHBondContact O-CG 3.47Å; S203-K207 PolarHBondContact O-N 2.93Å; S203-K207 VanDerWaalsContact O-N 3.12Å; S203-K207 PolarHBondContact OG-NZ 3.01Å
204	N	41.5	Very low	41.6	Very low	89 Å²	89	105.7 Å²	105.7	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-75.3	-40.1	-179.7	-76.8	-10.6	0	0	0	112.7	R200 H201 M202 R206 K207 N208	R200-N204 PolarHBondContact O-N 3.37Å; H201-N204 PolarHBondContact O-N 3.1Å; M202-N204 VanDerWaalsContact C-N 3.31Å; M202-N204 PolarHBondContact O-N 3.3Å; N204-R206 VanDerWaalsContact C-N 3.34Å; N204-R206 PolarHBondContact O-N 3.07Å; N204-K207 PolarHBondContact O-N 3.37Å; N204-N208 PolarHBondContact O-N 3.31Å
205	C	35.8	Very low	41	Very low	70 Å²	70	104.6 Å²	104.6	47%	0.473	53%	0.532	S	S	.	.	H	α-helix	trans	-60.6	-43.4	173.4	-64.6	0	0	0	0	111.5	H201 M202 K207 N208 S209	H201-C205 PolarHBondContact O-N 2.98Å; M202-C205 PolarHBondContact O-N 2.87Å; C205-K207 VanDerWaalsContact C-N 3.34Å; C205-K207 PolarHBondContact O-N 3.01Å; C205-N208 PolarHBondContact O-N 3.47Å; C205-S209 PolarHBondContact O-N 2.95Å
206	R	34.2	Very low	40.5	Very low	184 Å²	184	102.9 Å²	102.9	69%	0.694	53%	0.532	S	S	*	.	H	α-helix	trans	-63.5	-37.8	176.7	-160.5	170.3	-173.5	163.4	1.8	112.3	M202 N204 H210	M202-R206 WeakPolarHBondContact O-CB 3.42Å; M202-R206 PolarHBondContact O-N 3.35Å; M202-R206 VanDerWaalsContact O-N 3.08Å; N204-R206 VanDerWaalsContact C-N 3.34Å; N204-R206 PolarHBondContact O-N 3.07Å; R206-H210 PolarHBondContact O-N 3.2Å
207	K	38.6	Very low	39.9	Very low	121 Å²	121	106.9 Å²	106.9	53%	0.526	55%	0.549	S	S	.	.	H	α-helix	trans	-65.8	-43.3	172.8	-74.6	162	-177	152	0	112.5	S203 N204 C205 H210 R211	S203-K207 WeakPolarHBondContact O-CD 3.47Å; S203-K207 VanDerWaalsContact O-CG 3.24Å; S203-K207 WeakPolarHBondContact O-CG 3.47Å; S203-K207 PolarHBondContact O-N 2.93Å; S203-K207 VanDerWaalsContact O-N 3.12Å; S203-K207 PolarHBondContact OG-NZ 3.01Å; N204-K207 PolarHBondContact O-N 3.37Å; C205-K207 VanDerWaalsContact C-N 3.34Å; C205-K207 PolarHBondContact O-N 3.01Å; K207-H210 PolarHBondContact O-N 3.34Å; K207-R211 WeakPolarHBondContact O-CB 3.23Å; K207-R211 PolarHBondContact O-N 3.44Å
208	N	40.7	Very low	39	Very low	105 Å²	105	108.1 Å²	108.1	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-65	-42.2	178.1	-92.3	1.3	0	0	0	112.3	N204 C205 R211 Q212	N204-N208 PolarHBondContact O-N 3.31Å; C205-N208 PolarHBondContact O-N 3.47Å; N208-R211 PolarHBondContact O-N 2.78Å; N208-R211 VanDerWaalsContact O-N 3.12Å; N208-Q212 PolarHBondContact O-N 3.37Å
209	S	36.1	Very low	38.6	Very low	57 Å²	57	112.2 Å²	112.2	40%	0.399	58%	0.58	S	S	.	*	H	α-helix	trans	-57.8	-51	174.3	174.5	0	0	0	0	111.7	C205 R211 Q212 I213	C205-S209 PolarHBondContact O-N 2.95Å; S209-R211 VanDerWaalsContact C-N 3.29Å; S209-R211 PolarHBondContact O-N 3.14Å; S209-Q212 PolarHBondContact O-N 3.42Å; S209-I213 WeakPolarHBondContact O-CD1 3.49Å; S209-I213 VanDerWaalsContact O-CG1 3.28Å; S209-I213 WeakPolarHBondContact O-CG1 3.25Å; S209-I213 PolarHBondContact O-N 3.1Å
210	H	39.1	Very low	37.5	Very low	130 Å²	130	116.9 Å²	116.9	60%	0.602	59%	0.593	S	S	*	*	H	α-helix	trans	-60.9	-35	173.8	-89.8	14.1	0	0	0	113.2	R206 K207 I213 S214	R206-H210 PolarHBondContact O-N 3.2Å; K207-H210 PolarHBondContact O-N 3.34Å; H210-I213 PolarHBondContact O-N 3.37Å; H210-S214 WeakPolarHBondContact O-CB 3.33Å; H210-S214 PolarHBondContact O-N 3.2Å; H210-S214 PolarHBondContact O-OG 2.9Å
211	R	36.5	Very low	37.2	Very low	185 Å²	185	117.2 Å²	117.2	70%	0.698	60%	0.604	S	S	*	*	H	α-helix	trans	-67.2	-42.7	178.3	-158.2	172.8	-168.2	175.2	2.9	111.9	K207 N208 S209 S214 A215	K207-R211 WeakPolarHBondContact O-CB 3.23Å; K207-R211 PolarHBondContact O-N 3.44Å; N208-R211 PolarHBondContact O-N 2.78Å; N208-R211 VanDerWaalsContact O-N 3.12Å; S209-R211 VanDerWaalsContact C-N 3.29Å; S209-R211 PolarHBondContact O-N 3.14Å; R211-S214 WeakPolarHBondContact CA-OG 3.26Å; R211-S214 PolarHBondContact O-N 3.17Å; R211-S214 PolarHBondContact O-OG 3.39Å; R211-A215 WeakPolarHBondContact O-CB 3.23Å; R211-A215 PolarHBondContact O-N 3.4Å
212	Q	41.4	Very low	37	Very low	146 Å²	146	120.5 Å²	120.5	68%	0.682	62%	0.62	S	S	*	*	H	α-helix	trans	-63.1	-45.9	173.4	-74.7	-179.4	-48	0	0	111.8	N208 S209 S214 A215 S216	N208-Q212 PolarHBondContact O-N 3.37Å; S209-Q212 PolarHBondContact O-N 3.42Å; Q212-S214 PolarHBondContact O-N 3.02Å; Q212-A215 PolarHBondContact O-N 3.33Å; Q212-A215 VanDerWaalsContact O-N 3.11Å; Q212-S216 PolarHBondContact O-N 2.9Å; Q212-S216 PolarHBondContact O-OG 3.44Å
213	I	41.5	Very low	36.8	Very low	82 Å²	82	120.2 Å²	120.2	42%	0.421	62%	0.621	S	S	.	*	H	α-helix	trans	-63.3	-25.4	176.6	-64.8	164.2	0	0	0	112.4	S209 H210	S209-I213 WeakPolarHBondContact O-CD1 3.49Å; S209-I213 VanDerWaalsContact O-CG1 3.28Å; S209-I213 WeakPolarHBondContact O-CG1 3.25Å; S209-I213 PolarHBondContact O-N 3.1Å; H210-I213 PolarHBondContact O-N 3.37Å
214	S	37	Very low	36.6	Very low	79 Å²	79	123.9 Å²	123.9	55%	0.552	64%	0.641	S	S	*	*	H	α-helix	trans	-82.7	-32.5	173.3	74.4	0	0	0	0	113.6	H210 R211 Q212	H210-S214 WeakPolarHBondContact O-CB 3.33Å; H210-S214 PolarHBondContact O-N 3.2Å; H210-S214 PolarHBondContact O-OG 2.9Å; R211-S214 WeakPolarHBondContact CA-OG 3.26Å; R211-S214 PolarHBondContact O-N 3.17Å; R211-S214 PolarHBondContact O-OG 3.39Å; Q212-S214 PolarHBondContact O-N 3.02Å
215	A	39.2	Very low	36.3	Very low	69 Å²	69	126.2 Å²	126.2	57%	0.57	65%	0.647	S	S	*	*	H	α-helix	trans	-72.3	-42.7	179	0	0	0	0	0	111.4	R211 Q212 K217 G218	R211-A215 WeakPolarHBondContact O-CB 3.23Å; R211-A215 PolarHBondContact O-N 3.4Å; Q212-A215 PolarHBondContact O-N 3.33Å; Q212-A215 VanDerWaalsContact O-N 3.11Å; A215-K217 PolarHBondContact O-N 3.08Å; A215-G218 PolarHBondContact O-N 3.4Å
216	S	39.3	Very low	36.6	Very low	92 Å²	92	127.6 Å²	127.6	64%	0.643	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	12.2	177.8	70.1	0	0	0	0	114.6	Q212	Q212-S216 PolarHBondContact O-N 2.9Å; Q212-S216 PolarHBondContact O-OG 3.44Å
217	K	39.1	Very low	36.8	Very low	167 Å²	167	128.6 Å²	128.6	73%	0.726	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.6	15.3	175.5	-71.9	-179.2	175.7	172.2	0	112.6	A215	A215-K217 PolarHBondContact O-N 3.08Å
218	G	33.4	Very low	37	Very low	62 Å²	62	128 Å²	128	64%	0.639	66%	0.661	S	S	*	*	S	Bend	trans	-101.8	-19.7	176.6	0	0	0	0	0	115.6	A215	A215-G218 PolarHBondContact O-N 3.4Å
219	E	32.6	Very low	37.3	Very low	168 Å²	168	125.4 Å²	125.4	79%	0.785	65%	0.648	S	S	*	*			trans	-84.9	142.7	-177.3	-100.9	158.2	160	0	0	112.8
220	K	29	Very low	37.5	Very low	192 Å²	192	131.2 Å²	131.2	84%	0.835	66%	0.661	S	S	*	*			trans	-111.9	76.2	-174.8	-68.5	-177.3	179.7	178.5	0	110.6	E222	K220-E222 PolarHBondContact O-N 2.86Å
221	D	33.1	Very low	38.1	Very low	137 Å²	137	128.9 Å²	128.9	73%	0.733	66%	0.656	S	S	*	*			trans	-84	114	173.7	-71.7	-32.6	0	0	0	111.2	N223	D221-N223 PolarHBondContact O-N 3.11Å
222	E	31.5	Very low	39.1	Very low	201 Å²	201	126.5 Å²	126.5	94%	0.939	65%	0.651	S	S	*	*	S	Bend	trans	-78.8	42.8	-175.2	-59.7	-170.3	140.2	0	0	113.4	K220	K220-E222 PolarHBondContact O-N 2.86Å
223	N	33.5	Very low	39.6	Very low	139 Å²	139	123.2 Å²	123.2	74%	0.743	64%	0.637	S	S	*	*			trans	-152.4	61.4	178.8	-160.7	6.5	0	0	0	114.9	D221	D221-N223 PolarHBondContact O-N 3.11Å
224	V	35.7	Very low	40	Very low	127 Å²	127	124.5 Å²	124.5	77%	0.77	64%	0.642	S	S	*	*			trans	-115.8	101.1	171.6	-175.5	0	0	0	0	110.2
225	K	35.3	Very low	41.1	Very low	138 Å²	138	124.5 Å²	124.5	60%	0.6	64%	0.638	S	S	*	*			trans	-63.1	133.4	171.3	-76.4	170.8	168.9	-82.8	0	110.3	D229	K225-D229 HydrophobicContact CB-CB 4.39Å; K225-D229 WeakPolarHBondContact CD-OD2 3.26Å; K225-D229 IonicContact NZ-OD2 2.74Å; K225-D229 PolarHBondContact NZ-OD2 3.13Å
226	T	41.7	Very low	41.9	Very low	99 Å²	99	126.5 Å²	126.5	61%	0.607	64%	0.635	S	S	*	*			trans	-75.4	161.6	177.6	44.9	0	0	0	0	112.3	D228 D229	T226-D228 PolarHBondContact O-N 2.95Å; T226-D228 VanDerWaalsContact O-N 3.11Å; T226-D229 WeakPolarHBondContact O-CB 3.34Å; T226-D229 PolarHBondContact O-N 2.91Å
227	Y	38.2	Very low	42.6	Very low	204 Å²	204	129 Å²	129	80%	0.8	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-32.5	-172.7	-160	-107.2	0	0	0	113.8	D229 W230	Y227-D229 PolarHBondContact O-N 3.02Å; Y227-D229 VanDerWaalsContact O-N 3.17Å; Y227-W230 PolarHBondContact O-N 3.25Å
228	D	42.4	Very low	43.2	Very low	109 Å²	109	127.1 Å²	127.1	58%	0.583	63%	0.628	S	S	*	*	H	α-helix	trans	-66.9	-11.2	179.6	-48.1	-60.1	0	0	0	115	T226 T231	T226-D228 PolarHBondContact O-N 2.95Å; T226-D228 VanDerWaalsContact O-N 3.11Å; D228-T231 PolarHBondContact O-OG1 3.37Å
229	D	47.2	Very low	44.2	Very low	51 Å²	51	128.8 Å²	128.8	27%	0.273	62%	0.623	S	S	.	*	H	α-helix	trans	-86.2	-25.4	179	-137.7	45.9	0	0	0	111.8	K225 T226 Y227 L233	K225-D229 HydrophobicContact CB-CB 4.39Å; K225-D229 WeakPolarHBondContact CD-OD2 3.26Å; K225-D229 IonicContact NZ-OD2 2.74Å; K225-D229 PolarHBondContact NZ-OD2 3.13Å; T226-D229 WeakPolarHBondContact O-CB 3.34Å; T226-D229 PolarHBondContact O-N 2.91Å; Y227-D229 PolarHBondContact O-N 3.02Å; Y227-D229 VanDerWaalsContact O-N 3.17Å; D229-L233 PolarHBondContact O-N 3.02Å
230	W	40	Very low	45	Very low	179 Å²	179	127.4 Å²	127.4	68%	0.678	62%	0.616	S	S	*	*	H	α-helix	trans	-75.9	-37	179.1	-97.8	87	0	0	0	113.3	Y227 K232 L233 Q234	Y227-W230 PolarHBondContact O-N 3.25Å; W230-K232 VanDerWaalsContact C-N 3.33Å; W230-K232 PolarHBondContact O-N 3.18Å; W230-L233 PolarHBondContact O-N 3.38Å; W230-Q234 PolarHBondContact O-N 3.35Å; W230-Q234 VanDerWaalsContact O-N 3.12Å
231	T	53.6	Low	45.7	Very low	80 Å²	80	122.2 Å²	122.2	49%	0.491	61%	0.609	S	S	.	*	H	α-helix	trans	-66	-36.3	177.1	47.3	0	0	0	0	111.7	D228 Q234 V235	D228-T231 PolarHBondContact O-OG1 3.37Å; T231-Q234 PolarHBondContact O-N 3Å; T231-V235 PolarHBondContact O-N 3.45Å
232	K	55.9	Low	46.3	Very low	136 Å²	136	120.7 Å²	120.7	59%	0.591	61%	0.605	S	S	*	*	H	α-helix	trans	-63.6	-44.3	171.9	-67.9	177.1	-175.9	170.7	0	112.2	W230 Q234 V235 E236	W230-K232 VanDerWaalsContact C-N 3.33Å; W230-K232 PolarHBondContact O-N 3.18Å; K232-Q234 VanDerWaalsContact C-N 3.25Å; K232-Q234 PolarHBondContact O-N 3.23Å; K232-V235 PolarHBondContact O-N 2.97Å; K232-E236 WeakPolarHBondContact O-CB 3.37Å; K232-E236 PolarHBondContact O-N 2.99Å
233	L	52.9	Low	46.6	Very low	77 Å²	77	116.7 Å²	116.7	40%	0.403	59%	0.594	S	S	.	*	H	α-helix	trans	-67.3	-19.9	178.2	-77.5	167.3	0	0	0	114.2	D229 W230	D229-L233 PolarHBondContact O-N 3.02Å; W230-L233 PolarHBondContact O-N 3.38Å
234	Q	48.8	Very low	46.8	Very low	109 Å²	109	116.9 Å²	116.9	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-73.8	-56	167.5	-70.9	-76.4	-98.6	0	0	110.7	W230 T231 K232 E236 K237 E238	W230-Q234 PolarHBondContact O-N 3.35Å; W230-Q234 VanDerWaalsContact O-N 3.12Å; T231-Q234 PolarHBondContact O-N 3Å; K232-Q234 VanDerWaalsContact C-N 3.25Å; K232-Q234 PolarHBondContact O-N 3.23Å; Q234-E236 VanDerWaalsContact C-N 3.26Å; Q234-E236 PolarHBondContact O-N 3.36Å; Q234-K237 PolarHBondContact O-N 2.92Å; Q234-E238 PolarHBondContact O-N 3.28Å
235	V	61.8	Low	46.6	Very low	78 Å²	78	113.7 Å²	113.7	47%	0.473	59%	0.593	S	S	.	*	H	α-helix	trans	-58.1	-37.6	-179.8	173.7	0	0	0	0	112	T231 K232 K237 E238 N239	T231-V235 PolarHBondContact O-N 3.45Å; K232-V235 PolarHBondContact O-N 2.97Å; V235-K237 VanDerWaalsContact C-N 3.33Å; V235-K237 PolarHBondContact O-N 3.36Å; V235-E238 PolarHBondContact O-N 2.88Å; V235-N239 WeakPolarHBondContact CG1-ND2 3.3Å; V235-N239 WeakPolarHBondContact O-CB 3.43Å; V235-N239 PolarHBondContact O-N 2.73Å; V235-N239 VanDerWaalsContact O-N 3.09Å; V235-N239 PolarHBondContact O-ND2 2.96Å
236	E	55.2	Low	46.7	Very low	111 Å²	111	114.4 Å²	114.4	52%	0.519	61%	0.609	S	S	.	*	H	α-helix	trans	-69.5	-28.7	177.9	-166.5	164.9	-134.4	0	0	112.8	K232 Q234 Q240	K232-E236 WeakPolarHBondContact O-CB 3.37Å; K232-E236 PolarHBondContact O-N 2.99Å; Q234-E236 VanDerWaalsContact C-N 3.26Å; Q234-E236 PolarHBondContact O-N 3.36Å; E236-Q240 VanDerWaalsContact O-CG 3.3Å; E236-Q240 WeakPolarHBondContact O-CG 3.5Å; E236-Q240 PolarHBondContact O-N 3Å
237	K	53.8	Low	46.1	Very low	146 Å²	146	113.1 Å²	113.1	64%	0.635	62%	0.616	S	S	*	*	H	α-helix	trans	-77.4	-38.2	172	-81.6	-173.4	171.3	-173.4	0	113	Q234 V235 N239 Q240 A241	Q234-K237 PolarHBondContact O-N 2.92Å; V235-K237 VanDerWaalsContact C-N 3.33Å; V235-K237 PolarHBondContact O-N 3.36Å; K237-N239 VanDerWaalsContact C-N 3.35Å; K237-Q240 PolarHBondContact O-N 2.97Å; K237-A241 PolarHBondContact O-N 2.77Å; K237-A241 VanDerWaalsContact O-N 3.12Å
238	E	51.2	Low	46.1	Very low	126 Å²	126	110.3 Å²	110.3	59%	0.589	62%	0.62	S	S	*	*	H	α-helix	trans	-67.4	-36.2	178.2	-68.2	177.7	140.4	0	0	111.8	Q234 V235 Q240 A241 T242	Q234-E238 PolarHBondContact O-N 3.28Å; V235-E238 PolarHBondContact O-N 2.88Å; E238-Q240 VanDerWaalsContact C-N 3.33Å; E238-Q240 PolarHBondContact O-N 2.79Å; E238-A241 PolarHBondContact O-N 3.49Å; E238-T242 PolarHBondContact O-OG1 2.74Å
239	N	54	Low	45.6	Very low	98 Å²	98	112.4 Å²	112.4	52%	0.524	63%	0.632	S	S	.	*	H	α-helix	trans	-69.4	-25.7	172.8	-72.8	-49.3	0	0	0	113.7	V235 K237 T242 T243	V235-N239 WeakPolarHBondContact CG1-ND2 3.3Å; V235-N239 WeakPolarHBondContact O-CB 3.43Å; V235-N239 PolarHBondContact O-N 2.73Å; V235-N239 VanDerWaalsContact O-N 3.09Å; V235-N239 PolarHBondContact O-ND2 2.96Å; K237-N239 VanDerWaalsContact C-N 3.35Å; N239-T242 WeakPolarHBondContact CA-OG1 3.33Å; N239-T242 PolarHBondContact O-OG1 3.42Å; N239-T243 PolarHBondContact O-OG1 3.2Å
240	Q	49.3	Very low	45.2	Very low	138 Å²	138	118.6 Å²	118.6	65%	0.645	66%	0.659	S	S	*	*	H	α-helix	trans	-81.1	-20.8	173.2	-72.7	175.1	23.1	0	0	112.9	E236 K237 E238	E236-Q240 VanDerWaalsContact O-CG 3.3Å; E236-Q240 WeakPolarHBondContact O-CG 3.5Å; E236-Q240 PolarHBondContact O-N 3Å; K237-Q240 PolarHBondContact O-N 2.97Å; E238-Q240 VanDerWaalsContact C-N 3.33Å; E238-Q240 PolarHBondContact O-N 2.79Å
241	A	45.5	Very low	45.2	Very low	83 Å²	83	117.8 Å²	117.8	69%	0.686	67%	0.668	S	S	*	*	S	Bend	trans	-81.8	-11	175.8	0	0	0	0	0	114	K237 E238	K237-A241 PolarHBondContact O-N 2.77Å; K237-A241 VanDerWaalsContact O-N 3.12Å; E238-A241 PolarHBondContact O-N 3.49Å
242	T	44.2	Very low	44.4	Very low	106 Å²	106	118 Å²	118	65%	0.65	68%	0.678	S	S	*	*	S	Bend	trans	-111.1	3.9	-168.7	39.2	0	0	0	0	114.7	E238 N239	E238-T242 PolarHBondContact O-OG1 2.74Å; N239-T242 WeakPolarHBondContact CA-OG1 3.33Å; N239-T242 PolarHBondContact O-OG1 3.42Å
243	T	38.2	Very low	43.6	Very low	116 Å²	116	121 Å²	121	71%	0.712	69%	0.691	S	S	*	*			trans	-109.6	50.9	-175.6	35	0	0	0	0	113.7	N239	N239-T243 PolarHBondContact O-OG1 3.2Å
244	V	37.5	Very low	43	Very low	143 Å²	143	126.2 Å²	126.2	87%	0.867	71%	0.713	S	S	*	*			trans	-131.3	97.9	171.9	-176.6	0	0	0	0	110.9
245	G	32.8	Very low	42.4	Very low	61 Å²	61	125.9 Å²	125.9	63%	0.629	72%	0.723	S	S	*	*			trans	157.7	133.5	171.7	0	0	0	0	0	114
246	T	36	Very low	41.3	Very low	152 Å²	152	127.5 Å²	127.5	93%	0.933	74%	0.738	S	S	*	*			trans	62.8	130.6	-178.5	69.7	0	0	0	0	116
247	G	30.4	Very low	40.5	Very low	73 Å²	73	128.8 Å²	128.8	75%	0.753	75%	0.753	S	S	*	*			cis	127.7	94.8	-20.8	0	0	0	0	0	115.7
248	T	38	Very low	39.9	Very low	145 Å²	145	127.5 Å²	127.5	89%	0.89	76%	0.76	S	S	*	*			trans	-156	157.6	162.6	20.2	0	0	0	0	110.6
249	N	32.1	Very low	39.2	Very low	153 Å²	153	128 Å²	128	82%	0.818	77%	0.772	S	S	*	*			trans	-78	163.7	175.7	-54	-58.5	0	0	0	110.7
250	E	38.3	Very low	38.4	Very low	180 Å²	180	127.9 Å²	127.9	84%	0.841	79%	0.785	S	S	*	*				-169.5	146.5	77.5	-87.9	172.4	170.9	0	0	114.3
251	D	39.2	Very low	38	Very low	162 Å²	162	127.6 Å²	127.6	87%	0.866	79%	0.792	S	S	*	*			trans	69.6	155.1	146.8	-85.3	-16.2	0	0	0	126.9
252	A	37.6	Very low	38	Very low	86 Å²	86	129.2 Å²	129.2	71%	0.711	80%	0.796	S	S	*	*			trans	87.9	66.4	153.3	0	0	0	0	0	122.9
253	K	38.7	Very low	37.4	Very low	198 Å²	198	134.4 Å²	134.4	86%	0.861	80%	0.803	S	S	*	*				51.9	147.6	120.3	-74.7	174.4	175.7	164.8	0	123.3
254	Q	39.6	Very low	37.5	Very low	187 Å²	187	138.9 Å²	138.9	87%	0.874	81%	0.813	S	S	*	*			trans	79.3	139.7	164.4	-63.9	172.5	11	0	0	117
255	S	36.2	Very low	37.1	Very low	101 Å²	101	138.5 Å²	138.5	71%	0.706	80%	0.802	S	S	*	*			cis	-164	169.3	-16.9	63.8	0	0	0	0	112.8
256	S	40.5	Very low	37.5	Very low	113 Å²	113	144.1 Å²	144.1	79%	0.79	82%	0.816	S	S	*	*			trans	78.5	162.5	166.7	79.5	0	0	0	0	118.8
257	T	37.1	Very low	37.4	Very low	137 Å²	137	144.5 Å²	144.5	84%	0.84	81%	0.808	S	S	*	*			trans	-146.8	169.6	-152	23	0	0	0	0	112.3
258	P	42.2	Very low	37.8	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	81%	0.81	S	S	*	*			trans	-96.5	-175.5	-146.6	39.3	-40.4	0	0	0	116.3
259	T	36.2	Very low	37.6	Very low	137 Å²	137	145.5 Å²	145.5	84%	0.84	81%	0.808	S	S	*	*			trans	-145.4	143.4	165.8	-65.8	0	0	0	0	110
260	A	36.4	Very low	37.8	Very low	95 Å²	95	143.2 Å²	143.2	79%	0.785	80%	0.804	S	S	*	*			trans	-145	137.8	178.4	0	0	0	0	0	111.2
261	T	42.4	Very low	37.7	Very low	132 Å²	132	144.4 Å²	144.4	81%	0.81	81%	0.807	S	S	*	*			trans	-162.8	159.7	171.9	19.5	0	0	0	0	110.6
262	P	44	Very low	37.4	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	80%	0.801	S	S	*	*			trans	-142	-157.3	-133.7	37.3	-13.7	0	0	0	115.7
263	R	31.5	Very low	37.3	Very low	214 Å²	214	141.2 Å²	141.2	81%	0.808	80%	0.803	S	S	*	*			trans	93.1	122.2	140.1	-162.7	-175.5	-166.3	-170.5	5.4	119.5
264	K	40.3	Very low	37.1	Very low	210 Å²	210	137.1 Å²	137.1	91%	0.913	80%	0.795	S	S	*	*			trans	-158.8	136.2	132.6	-113.3	171.6	-175.7	177.4	0	111.3
265	E	29.9	Very low	36.8	Very low	135 Å²	135	135 Å²	135	63%	0.631	79%	0.79	S	S	*	*			trans	-117.9	158.3	171.3	-67.5	175.4	-177.6	0	0	109.2	H267	E265-H267 IonicContact OE2-CE1 2.73Å; E265-H267 PolarHBondContact OE2-CE1 2.89Å; E265-H267 IonicContact OE2-ND1 2.74Å
266	L	41.6	Very low	36.9	Very low	179 Å²	179	137.3 Å²	137.3	94%	0.937	79%	0.794	S	S	*	*			trans	-138.5	138	155.2	-78.8	175.8	0	0	0	109.3
267	H	32.9	Very low	36.7	Very low	161 Å²	161	136.7 Å²	136.7	75%	0.745	79%	0.79	S	S	*	*			trans	-104.4	155.2	-178.3	-84.6	56.2	0	0	0	111.6	E265	E265-H267 IonicContact OE2-CE1 2.73Å; E265-H267 PolarHBondContact OE2-CE1 2.89Å; E265-H267 IonicContact OE2-ND1 2.74Å
268	G	39.9	Very low	36.9	Very low	77 Å²	77	134.7 Å²	134.7	79%	0.794	78%	0.781	S	S	*	*			trans	-159.4	117.1	169.2	0	0	0	0	0	112.6
269	N	32.4	Very low	36.8	Very low	161 Å²	161	137.5 Å²	137.5	86%	0.861	78%	0.784	S	S	*	*			trans	-96.3	150.2	-179.3	-74.5	-24.3	0	0	0	112.1
270	S	36.9	Very low	37	Very low	105 Å²	105	135 Å²	135	73%	0.734	77%	0.772	S	S	*	*				172.6	115.6	112.2	-176.1	0	0	0	0	116
271	K	36.5	Very low	37.1	Very low	206 Å²	206	137.8 Å²	137.8	90%	0.896	77%	0.774	S	S	*	*			trans	21	137.5	137.3	-51.8	175.3	-179.6	179.1	0	121.8
272	G	33.2	Very low	37	Very low	73 Å²	73	136.3 Å²	136.3	75%	0.753	77%	0.769	S	S	*	*				145.7	130.7	121.3	0	0	0	0	0	119.8
273	S	35.8	Very low	36.8	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	77%	0.767	S	S	*	*			trans	62.6	125.7	163.6	-160.6	0	0	0	0	118.2
274	T	33.1	Very low	37.2	Very low	112 Å²	112	133.6 Å²	133.6	69%	0.687	76%	0.764	S	S	*	*			cis	98.3	123.3	20.5	70.5	0	0	0	0	118.1
275	N	34.7	Very low	37.1	Very low	143 Å²	143	132.5 Å²	132.5	77%	0.765	76%	0.759	S	S	*	*			trans	101.9	150.7	145	-67.9	-2.8	0	0	0	122.8
276	N	36.9	Very low	37.5	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	76%	0.762	S	S	*	*			trans	75.1	120.7	172.3	-54.9	-8.7	0	0	0	116.9
277	S	36.2	Very low	37.4	Very low	100 Å²	100	127.8 Å²	127.8	70%	0.699	76%	0.756	S	S	*	*			cis	112.3	130.4	0.6	83.7	0	0	0	0	117.2
278	S	41.4	Very low	38	Very low	94 Å²	94	126.2 Å²	126.2	66%	0.657	76%	0.76	S	S	*	*			trans	102.3	124.9	143.7	-57.5	0	0	0	0	121
279	Q	40.9	Very low	38	Very low	180 Å²	180	126.3 Å²	126.3	84%	0.841	76%	0.761	S	S	*	*			trans	72.7	146.4	141.6	-69.7	169.7	-59.8	0	0	119.1
280	S	39.4	Very low	38.2	Very low	84 Å²	84	122.1 Å²	122.1	59%	0.587	76%	0.756	S	S	*	*			cis	-174.6	151.3	-10.4	49.7	0	0	0	0	111.9
281	N	39.1	Very low	38.4	Very low	154 Å²	154	126.4 Å²	126.4	82%	0.824	76%	0.761	S	S	*	*			trans	55.1	157.2	144.7	-59.8	3.9	0	0	0	119
282	S	41.1	Very low	38.4	Very low	101 Å²	101	127.9 Å²	127.9	71%	0.706	76%	0.761	S	S	*	*			cis	-168.6	-165.6	-16.2	49.4	0	0	0	0	106
283	E	39.7	Very low	38.7	Very low	155 Å²	155	131.2 Å²	131.2	72%	0.724	76%	0.761	S	S	*	*			cis	-163	130.5	7.1	-174.5	159.1	-160.1	0	0	111.8
284	T	39.4	Very low	38.9	Very low	119 Å²	119	132.5 Å²	132.5	73%	0.73	76%	0.758	S	S	*	*			trans	64.9	165.1	162.2	65.6	0	0	0	0	118.5
285	K	37.6	Very low	39.1	Very low	186 Å²	186	132.1 Å²	132.1	81%	0.809	76%	0.76	S	S	*	*			cis	-158.2	141.5	16.8	-144.7	162.7	-175.6	172.9	0	113
286	A	39.1	Very low	39.2	Very low	85 Å²	85	133.3 Å²	133.3	70%	0.702	76%	0.761	S	S	*	*			trans	34.7	150.4	137.2	0	0	0	0	0	122.9
287	T	40.3	Very low	39.3	Very low	131 Å²	131	132.2 Å²	132.2	80%	0.804	76%	0.764	S	S	*	*			cis	-169.8	153.6	-9.1	-94.3	0	0	0	0	109
288	P	44.9	Very low	39.4	Very low	127 Å²	127	133.3 Å²	133.3	83%	0.825	77%	0.769	S	S	*	*			trans	-120.4	-179.2	-162.9	43.2	-32.9	0	0	0	116.8
289	G	39.4	Very low	39.3	Very low	79 Å²	79	139.5 Å²	139.5	81%	0.814	78%	0.778	S	S	*	*			trans	-174.7	145.2	159.8	0	0	0	0	0	113.5
290	G	36.9	Very low	39.2	Very low	74 Å²	74	137.9 Å²	137.9	76%	0.763	78%	0.776	S	S	*	*			cis	178.4	139.6	-10.8	0	0	0	0	0	117.1
291	K	41	Very low	38.9	Very low	194 Å²	194	138.7 Å²	138.7	84%	0.843	78%	0.781	S	S	*	*			trans	54.5	108.4	147.5	-60.5	-179.6	178.3	179.1	0	121.9
292	R	35.9	Very low	38.9	Very low	238 Å²	238	140.5 Å²	140.5	90%	0.898	78%	0.784	S	S	*	*				-176.5	132	109.7	-94.8	172.7	-174.1	-139.5	1.1	108.1
293	L	40.7	Very low	38.7	Very low	143 Å²	143	141.6 Å²	141.6	75%	0.749	79%	0.787	S	S	*	*			cis	70.2	124.4	46.3	-62.1	174	0	0	0	112
294	I	39.9	Very low	38.6	Very low	135 Å²	135	141.8 Å²	141.8	69%	0.692	79%	0.793	S	S	*	*			cis	-148.3	163.5	8.4	-92	148.9	0	0	0	106.2
295	S	36.8	Very low	38.3	Very low	103 Å²	103	145 Å²	145	72%	0.72	80%	0.8	S	S	*	*			cis	-141.9	162.5	26	17.8	0	0	0	0	110.3
296	E	37.3	Very low	38.5	Very low	169 Å²	169	140.7 Å²	140.7	79%	0.79	79%	0.793	S	S	*	*			cis	90.1	95.6	44.8	-65.4	-175.8	-171.6	0	0	117
297	S	38.7	Very low	38.1	Very low	125 Å²	125	142.9 Å²	142.9	87%	0.874	80%	0.798	S	S	*	*			trans	176.3	103.1	130.7	-78.7	0	0	0	0	112
298	P	38.2	Very low	37.8	Very low	124 Å²	124	143 Å²	143	81%	0.805	79%	0.794	S	S	*	*			trans	-108.5	162.9	179.9	39	-32.1	0	0	0	114.1
299	R	39.2	Very low	37.1	Very low	223 Å²	223	140.9 Å²	140.9	84%	0.842	80%	0.795	S	S	*	*			trans	-144.3	130	156.7	-92.6	-166.2	-179.9	155.2	4.4	113.5
300	D	38.4	Very low	36.7	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	80%	0.796	S	S	*	*			trans	58.7	105.9	139.8	-46.7	-29.5	0	0	0	119.1
301	S	34.1	Very low	36.3	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	79%	0.786	S	S	*	*			trans	-95.8	141.6	177.6	54.6	0	0	0	0	113
302	H	39.1	Very low	35.8	Very low	192 Å²	192	142.7 Å²	142.7	89%	0.889	79%	0.787	S	S	*	*			trans	-124.3	121.4	147.1	-96.3	-86.3	0	0	0	108.6
303	T	35.4	Very low	35.6	Very low	124 Å²	124	139.6 Å²	139.6	76%	0.761	78%	0.783	S	S	*	*			trans	-109.7	114	176.2	48.9	0	0	0	0	109
304	D	38.1	Very low	35	Very low	159 Å²	159	137.5 Å²	137.5	85%	0.85	79%	0.786	S	S	*	*			trans	-109.7	132.4	155.4	-83.2	-52.7	0	0	0	107.5
305	E	34.4	Very low	34.5	Very low	186 Å²	186	140.2 Å²	140.2	87%	0.869	80%	0.796	S	S	*	*			trans	-106.5	93.4	-170.2	-172.9	174.8	-175.9	0	0	110.2
306	S	40.1	Very low	34.1	Very low	96 Å²	96	144.1 Å²	144.1	67%	0.671	80%	0.8	S	S	*	*			trans	-112	105.2	171.2	55.9	0	0	0	0	110.1	D308	S306-D308 PolarHBondContact O-N 3.38Å
307	T	31.8	Very low	33.8	Very low	130 Å²	130	143.8 Å²	143.8	80%	0.798	80%	0.804	S	S	*	*			trans	-76.9	86.7	177.7	52.2	0	0	0	0	111.5
308	D	34.5	Very low	33.8	Very low	135 Å²	135	143 Å²	143	72%	0.722	79%	0.794	S	S	*	*			trans	-102.2	133.5	167	-76.9	-61.2	0	0	0	111	S306 E310	S306-D308 PolarHBondContact O-N 3.38Å; D308-E310 VanDerWaalsContact C-N 3.34Å; D308-E310 PolarHBondContact O-N 3.18Å; D308-E310 VanDerWaalsContact O-N 3.08Å
309	G	28.6	Very low	34.1	Very low	82 Å²	82	145.9 Å²	145.9	85%	0.845	80%	0.797	S	S	*	*			trans	-84.9	68.2	-174.8	0	0	0	0	0	112.8	S311	G309-S311 PolarHBondContact O-N 2.92Å; G309-S311 VanDerWaalsContact O-N 3.08Å
310	E	32.4	Very low	35	Very low	180 Å²	180	137.9 Å²	137.9	84%	0.841	77%	0.77	S	S	*	*			trans	-61.6	108.9	176	-158.4	76.6	-132.7	0	0	110	D308	D308-E310 VanDerWaalsContact C-N 3.34Å; D308-E310 PolarHBondContact O-N 3.18Å; D308-E310 VanDerWaalsContact O-N 3.08Å
311	S	28.4	Very low	36	Very low	78 Å²	78	136.9 Å²	136.9	55%	0.545	76%	0.762	S	S	.	*			trans	-69.6	152.5	-177.7	39.4	0	0	0	0	112.4	G309 E313	G309-S311 PolarHBondContact O-N 2.92Å; G309-S311 VanDerWaalsContact O-N 3.08Å; S311-E313 VanDerWaalsContact C-N 3.25Å; S311-E313 PolarHBondContact O-N 2.71Å
312	S	29.9	Very low	37.9	Very low	126 Å²	126	135.9 Å²	135.9	88%	0.881	75%	0.749	S	S	*	*	S	Bend	trans	-72.3	63.7	-171.3	63.9	0	0	0	0	114.4
313	E	31.6	Very low	39.6	Very low	174 Å²	174	128.1 Å²	128.1	81%	0.813	72%	0.715	S	S	*	*			trans	-95.6	-0.9	-177.3	-55.9	-153.6	142.2	0	0	113.8	S311	S311-E313 VanDerWaalsContact C-N 3.25Å; S311-E313 PolarHBondContact O-N 2.71Å
314	A	27.7	Very low	41.6	Very low	98 Å²	98	122.3 Å²	122.3	81%	0.81	68%	0.679	S	S	*	*	S	Bend	trans	-96.5	-13.9	-168.3	0	0	0	0	0	117
315	E	30.1	Very low	43.7	Very low	192 Å²	192	115.5 Å²	115.5	90%	0.897	64%	0.644	S	S	*	*	S	Bend	trans	-118.6	37.7	-173.5	-66.4	-167.7	147.1	0	0	113.6
316	K	28	Very low	46.1	Very low	185 Å²	185	107.2 Å²	107.2	80%	0.804	61%	0.605	S	S	*	*			trans	-132	70.5	164.3	-76.7	-168.8	176.7	179.6	0	111.5	T318	K316-T318 PolarHBondContact O-N 3.23Å
317	D	31.7	Very low	48.3	Very low	162 Å²	162	106.8 Å²	106.8	87%	0.866	59%	0.593	S	S	*	*			trans	-51.7	111.7	143.7	-84.2	-21.9	0	0	0	107.1	E319	D317-E319 PolarHBondContact O-N 3.38Å
318	T	37.5	Very low	50.9	Low	109 Å²	109	100.6 Å²	100.6	67%	0.669	56%	0.555	S	S	*	*			trans	-73.3	94.7	-176.1	50.3	0	0	0	0	109	K316 L320	K316-T318 PolarHBondContact O-N 3.23Å; T318-L320 PolarHBondContact O-N 3.35Å
319	E	45.2	Very low	53.4	Low	185 Å²	185	95.2 Å²	95.2	86%	0.864	53%	0.526	S	S	*	.			trans	-47	111.9	162.9	-72.3	-168.3	141.9	0	0	108.2	D317 M321	D317-E319 PolarHBondContact O-N 3.38Å; E319-M321 PolarHBondContact O-N 2.87Å
320	L	57.4	Low	56.3	Low	54 Å²	54	94.7 Å²	94.7	28%	0.283	50%	0.502	S	S	.	.			trans	-65.5	109.9	-170.1	-60.7	167.6	0	0	0	107.8	T318 N322 R491 E524	T318-L320 PolarHBondContact O-N 3.35Å; L320-N322 PolarHBondContact O-N 2.87Å; L320-R491 VanDerWaalsContact CD1-CZ 3.49Å; L320-E524 HydrophobicContact CB-CB 4.32Å; L320-E524 VanDerWaalsContact CD1-OE2 3.29Å; L320-E524 WeakPolarHBondContact CD1-OE2 3.16Å
321	M	60.4	Low	59	Low	127 Å²	127	88 Å²	88	63%	0.626	47%	0.469	S	S	*	.			trans	-54	115.5	-171.4	-60	-146.8	80.5	0	0	109.5	E319 V323 R458	E319-M321 PolarHBondContact O-N 2.87Å; M321-V323 HydrophobicContact CB-CG2 4.42Å; M321-V323 PolarHBondContact O-N 3.49Å; M321-R458 PolarHBondContact O-NH1 3.29Å
322	N	72.5	Confident	61.8	Low	80 Å²	80	86.9 Å²	86.9	43%	0.428	45%	0.453	S	S	.	.			trans	-77.7	64.8	-171.1	-169	4.1	0	0	0	111.2	L320	L320-N322 PolarHBondContact O-N 2.87Å
323	V	75.5	Confident	64.7	Low	29 Å²	29	86.5 Å²	86.5	18%	0.176	44%	0.436	C	S	.	.			trans	-133.7	120	-173.2	-173	0	0	0	0	108	M321 C424 R458	M321-V323 HydrophobicContact CB-CG2 4.42Å; M321-V323 PolarHBondContact O-N 3.49Å; V323-C424 HydrophobicContact CG1-CB 3.86Å; V323-R458 PolarHBondContact O-NH1 2.91Å
324	P	77.9	Confident	67.4	Low	1 Å²	1	81 Å²	81	1%	0.006	41%	0.412	C	S	.	.	S	Bend	cis	-75.1	142.5	-4.2	33	-30.3	0	0	0	110.6	M326 C424 I459 F462	P324-M326 PolarHBondContact O-N 2.98Å; P324-M326 VanDerWaalsContact O-N 3.08Å; P324-C424 WeakPolarHBondContact CD-SG 3.35Å; P324-I459 HydrophobicContact CG-CG1 4.47Å; P324-F462 HydrophobicContact CB-CD2 3.67Å; P324-F462 HydrophobicContact CB-CE2 3.88Å; P324-F462 HydrophobicContact CB-CG 4.18Å; P324-F462 HydrophobicContact CG-CB 3.83Å; P324-F462 HydrophobicContact CG-CD2 3.55Å; P324-F462 HydrophobicContact CG-CE2 4.29Å; P324-F462 HydrophobicContact CG-CG 3.79Å
325	P	82.3	Confident	70.3	Confident	16 Å²	16	77.4 Å²	77.4	10%	0.104	38%	0.379	C	S	.	.			trans	-69.2	111.3	178.8	26.1	-31.4	0	0	0	110.1	E327 L328 I355	P325-E327 PolarHBondContact O-N 3.05Å; P325-E327 VanDerWaalsContact O-N 3.1Å; P325-L328 HydrophobicContact CG-CD1 3.7Å; P325-L328 HydrophobicContact CG-CG 4.12Å; P325-L328 WeakPolarHBondContact O-CG 3.47Å; P325-L328 PolarHBondContact O-N 2.95Å; P325-L328 VanDerWaalsContact O-N 3.17Å; P325-I355 HydrophobicContact CG-CG2 4.25Å
326	M	85.4	Confident	73	Confident	12 Å²	12	71.7 Å²	71.7	6%	0.059	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21	-168.6	-68.8	-64.7	-71.3	0	0	114.3	P324 L328 N329 M461 F462 L525	P324-M326 PolarHBondContact O-N 2.98Å; P324-M326 VanDerWaalsContact O-N 3.08Å; M326-L328 PolarHBondContact O-N 3.45Å; M326-N329 PolarHBondContact O-N 3.25Å; M326-M461 HydrophobicContact CE-CB 4.29Å; M326-F462 HydrophobicContact SD-CB 4.25Å; M326-F462 HydrophobicContact SD-CD2 4Å; M326-L525 HydrophobicContact CE-CD1 4.17Å
327	E	84.9	Confident	75.8	Confident	87 Å²	87	67.3 Å²	67.3	41%	0.407	34%	0.341	S	S	.	.	H	α-helix	trans	-59	-31.1	175.1	-65	-174.4	-151	0	0	113.7	P325 N329 Q330 Y331	P325-E327 PolarHBondContact O-N 3.05Å; P325-E327 VanDerWaalsContact O-N 3.1Å; E327-N329 PolarHBondContact O-N 2.64Å; E327-Q330 WeakPolarHBondContact O-CA 3.49Å; E327-Q330 VanDerWaalsContact O-CB 3.31Å; E327-Q330 WeakPolarHBondContact O-CB 3.35Å; E327-Q330 PolarHBondContact O-N 3.31Å; E327-Y331 HydrophobicContact CB-CD2 4.24Å; E327-Y331 HydrophobicContact CB-CE2 3.62Å; E327-Y331 WeakPolarHBondContact O-CD2 3.28Å; E327-Y331 PolarHBondContact O-N 2.82Å; E327-Y331 WeakPolarHBondContact OE2-CE2 3.48Å; E327-Y331 PolarHBondContact OE2-OH 3.09Å
328	L	87.7	Confident	78.1	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-53.5	-42.2	178.5	-71.4	171.5	0	0	0	112.1	P325 M326 Q330 Y331 Y332 L352 I355 M361 Y364 F462	P325-L328 HydrophobicContact CG-CD1 3.7Å; P325-L328 HydrophobicContact CG-CG 4.12Å; P325-L328 WeakPolarHBondContact O-CG 3.47Å; P325-L328 PolarHBondContact O-N 2.95Å; P325-L328 VanDerWaalsContact O-N 3.17Å; M326-L328 PolarHBondContact O-N 3.45Å; L328-Q330 VanDerWaalsContact C-N 3.3Å; L328-Q330 PolarHBondContact O-N 3.28Å; L328-Y331 PolarHBondContact O-N 3.22Å; L328-Y332 VanDerWaalsContact O-CB 3.28Å; L328-Y332 WeakPolarHBondContact O-CB 3.22Å; L328-Y332 PolarHBondContact O-N 3.41Å; L328-L352 HydrophobicContact CD2-CD1 3.62Å; L328-I355 HydrophobicContact CD1-CG2 4.45Å; L328-I355 HydrophobicContact CD2-CB 3.89Å; L328-I355 HydrophobicContact CD2-CD1 4.19Å; L328-I355 HydrophobicContact CD2-CG2 3.63Å; L328-I355 HydrophobicContact CG-CG2 4.18Å; L328-M361 HydrophobicContact CD1-CE 3.45Å; L328-M361 VanDerWaalsContact CD1-CE 3.45Å; L328-M361 HydrophobicContact CD1-SD 3.51Å; L328-M361 VanDerWaalsContact CD1-SD 3.51Å; L328-M361 HydrophobicContact CD2-SD 4.34Å; L328-Y364 HydrophobicContact CB-CE1 4.09Å; L328-Y364 HydrophobicContact CD1-CD1 4.44Å; L328-Y364 HydrophobicContact CD1-CE1 4.09Å; L328-Y364 HydrophobicContact CD2-CE1 4.15Å; L328-Y364 HydrophobicContact CG-CE1 4.37Å; L328-F462 HydrophobicContact CB-CE2 4.04Å; L328-F462 HydrophobicContact CB-CZ 4.07Å; L328-F462 HydrophobicContact CD1-CE2 4.29Å; L328-F462 HydrophobicContact CD1-CZ 4.23Å
329	N	87.1	Confident	80.3	Confident	23 Å²	23	67.1 Å²	67.1	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-69.5	-27.6	177.1	-86.1	-3.8	0	0	0	112.8	M326 E327 F333 F462	M326-N329 PolarHBondContact O-N 3.25Å; E327-N329 PolarHBondContact O-N 2.64Å; N329-F333 WeakPolarHBondContact O-CB 3.35Å; N329-F333 PolarHBondContact O-N 3.38Å; N329-F462 WeakPolarHBondContact ND2-CA 3.41Å; N329-F462 PolarHBondContact ND2-O 3.44Å; N329-F462 WeakPolarHBondContact OD1-CE1 3.47Å; N329-F462 WeakPolarHBondContact OD1-CZ 3.44Å
330	Q	88.1	Confident	81.8	Confident	71 Å²	71	59.1 Å²	59.1	33%	0.332	31%	0.305	S	S	.	.	H	α-helix	trans	-70.6	-47.6	173.6	-53.4	-174	13	0	0	110.3	E327 L328 F333 L334	E327-Q330 WeakPolarHBondContact O-CA 3.49Å; E327-Q330 VanDerWaalsContact O-CB 3.31Å; E327-Q330 WeakPolarHBondContact O-CB 3.35Å; E327-Q330 PolarHBondContact O-N 3.31Å; L328-Q330 VanDerWaalsContact C-N 3.3Å; L328-Q330 PolarHBondContact O-N 3.28Å; Q330-F333 PolarHBondContact O-N 3.4Å; Q330-L334 WeakPolarHBondContact O-CG 3.45Å; Q330-L334 PolarHBondContact O-N 3.41Å
331	Y	88.9	Confident	83.1	Confident	40 Å²	40	60.2 Å²	60.2	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-45.8	175.4	-57.8	-53.4	0	0	0	111.7	E327 L328 F333 L334 L335 A348 K351 I355	E327-Y331 HydrophobicContact CB-CD2 4.24Å; E327-Y331 HydrophobicContact CB-CE2 3.62Å; E327-Y331 WeakPolarHBondContact O-CD2 3.28Å; E327-Y331 PolarHBondContact O-N 2.82Å; E327-Y331 WeakPolarHBondContact OE2-CE2 3.48Å; E327-Y331 PolarHBondContact OE2-OH 3.09Å; L328-Y331 PolarHBondContact O-N 3.22Å; Y331-F333 PolarHBondContact O-N 3.47Å; Y331-L334 PolarHBondContact O-N 3.11Å; Y331-L335 WeakPolarHBondContact O-CD1 3.38Å; Y331-L335 VanDerWaalsContact O-CG 3.22Å; Y331-L335 WeakPolarHBondContact O-CG 3.49Å; Y331-L335 PolarHBondContact O-N 2.97Å; Y331-A348 HydrophobicContact CD1-CB 3.96Å; Y331-K351 HydrophobicContact CD1-CB 4.38Å; Y331-K351 HydrophobicContact CD2-CB 4.43Å; Y331-K351 HydrophobicContact CE1-CB 4.08Å; Y331-K351 HydrophobicContact CE1-CD 3.74Å; Y331-K351 HydrophobicContact CE2-CB 4.13Å; Y331-I355 HydrophobicContact CD2-CD1 4.2Å; Y331-I355 HydrophobicContact CE2-CD1 3.8Å
332	Y	88.7	Confident	84.2	Confident	53 Å²	53	59.8 Å²	59.8	21%	0.208	31%	0.311	C	S	.	.	H	α-helix	trans	-57.5	-44.5	174	173.1	-103.7	0	0	0	112.5	L328 L334 L335 S336 V368 E371 L372	L328-Y332 VanDerWaalsContact O-CB 3.28Å; L328-Y332 WeakPolarHBondContact O-CB 3.22Å; L328-Y332 PolarHBondContact O-N 3.41Å; Y332-L334 PolarHBondContact O-N 2.98Å; Y332-L335 PolarHBondContact O-N 3.29Å; Y332-S336 WeakPolarHBondContact O-CB 3.34Å; Y332-S336 PolarHBondContact O-N 2.63Å; Y332-V368 HydrophobicContact CD2-CG1 4.05Å; Y332-V368 HydrophobicContact CD2-CG2 3.97Å; Y332-V368 HydrophobicContact CE2-CG1 4.42Å; Y332-V368 HydrophobicContact CE2-CG2 4.34Å; Y332-E371 HydrophobicContact CE2-CB 4.2Å; Y332-E371 PolarHBondContact OH-OE2 3.22Å; Y332-L372 HydrophobicContact CD2-CD1 4.41Å; Y332-L372 HydrophobicContact CD2-CD2 4.48Å; Y332-L372 HydrophobicContact CD2-CG 4.45Å; Y332-L372 HydrophobicContact CE2-CD2 4.08Å; Y332-L372 HydrophobicContact CE2-CG 4.14Å
333	F	89.1	Confident	84.9	Confident	118 Å²	118	60.4 Å²	60.4	52%	0.518	32%	0.318	S	S	.	.	H	α-helix	trans	-66.4	-34	178	179.2	-122.3	0	0	0	113.3	N329 Q330 Y331 K337	N329-F333 WeakPolarHBondContact O-CB 3.35Å; N329-F333 PolarHBondContact O-N 3.38Å; Q330-F333 PolarHBondContact O-N 3.4Å; Y331-F333 PolarHBondContact O-N 3.47Å; F333-K337 WeakPolarHBondContact O-CG 3.4Å; F333-K337 PolarHBondContact O-N 2.86Å
334	L	89.5	Confident	85.4	Confident	59 Å²	59	62.8 Å²	62.8	31%	0.309	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-41.5	171.9	-71.1	169.7	0	0	0	111.7	Q330 Y331 Y332 K337 A348	Q330-L334 WeakPolarHBondContact O-CG 3.45Å; Q330-L334 PolarHBondContact O-N 3.41Å; Y331-L334 PolarHBondContact O-N 3.11Å; Y332-L334 PolarHBondContact O-N 2.98Å; L334-K337 PolarHBondContact O-N 3.39Å; L334-A348 HydrophobicContact CB-CB 4.31Å; L334-A348 HydrophobicContact CD1-CB 4.35Å
335	L	87.8	Confident	85.8	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.12	34%	0.336	C	S	.	.	H	α-helix	trans	-71.5	-29.9	178.9	-66.2	164.3	0	0	0	113.3	Y331 Y332 K337 K345 A348 K349 L352 L372 W374	Y331-L335 WeakPolarHBondContact O-CD1 3.38Å; Y331-L335 VanDerWaalsContact O-CG 3.22Å; Y331-L335 WeakPolarHBondContact O-CG 3.49Å; Y331-L335 PolarHBondContact O-N 2.97Å; Y332-L335 PolarHBondContact O-N 3.29Å; L335-K337 VanDerWaalsContact C-N 3.28Å; L335-K337 PolarHBondContact O-N 2.91Å; L335-K345 HydrophobicContact CD2-CB 4.12Å; L335-K345 WeakPolarHBondContact CD2-O 3.28Å; L335-A348 HydrophobicContact CD2-CB 4.31Å; L335-A348 HydrophobicContact CG-CB 4.2Å; L335-K349 HydrophobicContact CD2-CB 3.99Å; L335-L352 HydrophobicContact CD1-CD2 3.48Å; L335-L352 VanDerWaalsContact CD1-CD2 3.48Å; L335-L372 HydrophobicContact CB-CD1 3.87Å; L335-L372 HydrophobicContact CB-CD2 4.32Å; L335-L372 HydrophobicContact CD1-CD1 4.16Å; L335-W374 HydrophobicContact CD1-CH2 3.76Å; L335-W374 HydrophobicContact CD1-CZ2 4.39Å; L335-W374 HydrophobicContact CD2-CH2 3.98Å; L335-W374 HydrophobicContact CD2-CZ2 4.04Å; L335-W374 HydrophobicContact CG-CH2 4.39Å
336	S	86.8	Confident	86.1	Confident	71 Å²	71	69.6 Å²	69.6	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-70.2	-22.9	175.3	-174.9	0	0	0	0	112.9	Y332	Y332-S336 WeakPolarHBondContact O-CB 3.34Å; Y332-S336 PolarHBondContact O-N 2.63Å
337	K	87.3	Confident	86.4	Confident	93 Å²	93	73.4 Å²	73.4	40%	0.404	38%	0.377	S	S	.	.			trans	-82.9	124.9	-180	-75.8	175.7	178	179.8	0	112.4	F333 L334 L335 D339 C340 K345	F333-K337 WeakPolarHBondContact O-CG 3.4Å; F333-K337 PolarHBondContact O-N 2.86Å; L334-K337 PolarHBondContact O-N 3.39Å; L335-K337 VanDerWaalsContact C-N 3.28Å; L335-K337 PolarHBondContact O-N 2.91Å; K337-D339 VanDerWaalsContact C-N 3.32Å; K337-D339 PolarHBondContact O-N 2.82Å; K337-C340 HydrophobicContact CB-CB 4.37Å; K337-K345 WeakPolarHBondContact O-CE 3.27Å
338	T	80.8	Confident	86.6	Confident	116 Å²	116	69.4 Å²	69.4	71%	0.712	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-47	168.7	42.6	0	0	0	0	112.2	C340 K345	T338-C340 VanDerWaalsContact C-N 3.28Å; T338-C340 PolarHBondContact O-N 3.36Å; T338-K345 PolarHBondContact O-NZ 3.47Å; T338-K345 VanDerWaalsContact O-NZ 3.07Å
339	D	82.2	Confident	86.6	Confident	151 Å²	151	73.9 Å²	73.9	81%	0.807	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	2.3	-161.9	-44.5	-20.1	0	0	0	113.9	K337	K337-D339 VanDerWaalsContact C-N 3.32Å; K337-D339 PolarHBondContact O-N 2.82Å
340	C	76.6	Confident	86.8	Confident	18 Å²	18	76.3 Å²	76.3	12%	0.122	39%	0.394	C	S	.	.	S	Bend	trans	-74.8	138.9	178.9	-167.6	0	0	0	0	110.7	K337 T338 E342 K345	K337-C340 HydrophobicContact CB-CB 4.37Å; T338-C340 VanDerWaalsContact C-N 3.28Å; T338-C340 PolarHBondContact O-N 3.36Å; C340-E342 PolarHBondContact O-N 3.19Å; C340-K345 HydrophobicContact CB-CG 4.17Å; C340-K345 WeakPolarHBondContact O-CE 3.46Å; C340-K345 PolarHBondContact O-NZ 2.93Å; C340-K345 VanDerWaalsContact O-NZ 3.08Å
341	P	85.1	Confident	87	Confident	76 Å²	76	76.7 Å²	76.7	49%	0.494	39%	0.394	S	S	.	.			trans	-53.6	137.1	171.6	-28	35.2	0	0	0	112.6	T343 L344 K345	P341-T343 VanDerWaalsContact C-N 3.28Å; P341-T343 PolarHBondContact O-N 2.91Å; P341-L344 HydrophobicContact CB-CD1 4.38Å; P341-L344 HydrophobicContact CB-CG 4.49Å; P341-L344 HydrophobicContact CG-CD1 4.21Å; P341-L344 PolarHBondContact O-N 3.32Å; P341-K345 PolarHBondContact O-N 2.88Å
342	E	83.3	Confident	87	Confident	119 Å²	119	75 Å²	75	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-63.2	-33.6	-171.3	-150.9	62.5	-157.1	0	0	112.9	C340 L344 K345 E346	C340-E342 PolarHBondContact O-N 3.19Å; E342-L344 VanDerWaalsContact C-N 3.31Å; E342-L344 PolarHBondContact O-N 3.28Å; E342-K345 WeakPolarHBondContact O-CB 3.41Å; E342-K345 PolarHBondContact O-N 3.28Å; E342-K345 VanDerWaalsContact O-N 3.08Å; E342-K345 WeakPolarHBondContact OE2-CD 3.41Å; E342-K345 IonicContact OE2-NZ 3Å; E342-K345 PolarHBondContact OE2-NZ 3.38Å; E342-E346 PolarHBondContact O-N 2.91Å
343	T	87.8	Confident	87	Confident	93 Å²	93	74.3 Å²	74.3	57%	0.571	39%	0.387	S	S	*	.	H	α-helix	trans	-57.2	-42.5	173.3	51.3	0	0	0	0	112.5	P341 K345 E346 E347	P341-T343 VanDerWaalsContact C-N 3.28Å; P341-T343 PolarHBondContact O-N 2.91Å; T343-K345 VanDerWaalsContact C-N 3.34Å; T343-E346 PolarHBondContact O-N 3.21Å; T343-E347 PolarHBondContact O-N 2.85Å
344	L	86.9	Confident	87	Confident	79 Å²	79	74.4 Å²	74.4	41%	0.414	39%	0.389	S	S	.	.	H	α-helix	trans	-71.5	-29	177.6	-66.5	176.5	0	0	0	112	P341 E342 A348	P341-L344 HydrophobicContact CB-CD1 4.38Å; P341-L344 HydrophobicContact CB-CG 4.49Å; P341-L344 HydrophobicContact CG-CD1 4.21Å; P341-L344 PolarHBondContact O-N 3.32Å; E342-L344 VanDerWaalsContact C-N 3.31Å; E342-L344 PolarHBondContact O-N 3.28Å; L344-A348 WeakPolarHBondContact O-CB 3.44Å; L344-A348 PolarHBondContact O-N 2.7Å
345	K	86.4	Confident	86.9	Confident	33 Å²	33	73 Å²	73	14%	0.143	38%	0.382	C	S	.	.	H	α-helix	trans	-69.9	-41.8	170.8	-62.9	-178.5	-165	144	0	111.5	L335 K337 T338 C340 P341 E342 T343 A348 K349	L335-K345 HydrophobicContact CD2-CB 4.12Å; L335-K345 WeakPolarHBondContact CD2-O 3.28Å; K337-K345 WeakPolarHBondContact O-CE 3.27Å; T338-K345 PolarHBondContact O-NZ 3.47Å; T338-K345 VanDerWaalsContact O-NZ 3.07Å; C340-K345 HydrophobicContact CB-CG 4.17Å; C340-K345 WeakPolarHBondContact O-CE 3.46Å; C340-K345 PolarHBondContact O-NZ 2.93Å; C340-K345 VanDerWaalsContact O-NZ 3.08Å; P341-K345 PolarHBondContact O-N 2.88Å; E342-K345 WeakPolarHBondContact O-CB 3.41Å; E342-K345 PolarHBondContact O-N 3.28Å; E342-K345 VanDerWaalsContact O-N 3.08Å; E342-K345 WeakPolarHBondContact OE2-CD 3.41Å; E342-K345 IonicContact OE2-NZ 3Å; E342-K345 PolarHBondContact OE2-NZ 3.38Å; T343-K345 VanDerWaalsContact C-N 3.34Å; K345-A348 PolarHBondContact O-N 3.03Å; K345-K349 WeakPolarHBondContact O-CB 3.2Å; K345-K349 PolarHBondContact O-N 2.99Å
346	E	88.3	Confident	86.9	Confident	127 Å²	127	72.1 Å²	72.1	59%	0.593	38%	0.377	S	S	*	.	H	α-helix	trans	-64	-43.4	176.3	-70.7	-174.2	153.2	0	0	111.7	E342 T343 T350	E342-E346 PolarHBondContact O-N 2.91Å; T343-E346 PolarHBondContact O-N 3.21Å; E346-T350 WeakPolarHBondContact O-CB 3.27Å; E346-T350 PolarHBondContact O-N 3.37Å; E346-T350 PolarHBondContact O-OG1 2.88Å
347	E	90.6	Very high	86.9	Confident	92 Å²	92	74.8 Å²	74.8	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-51	171.4	-78.7	-170.5	-133.9	0	0	112.6	T343 K349 T350 K351	T343-E347 PolarHBondContact O-N 2.85Å; E347-K349 VanDerWaalsContact C-N 3.3Å; E347-K349 PolarHBondContact O-N 3.16Å; E347-T350 PolarHBondContact O-N 3.1Å; E347-T350 VanDerWaalsContact O-N 3.14Å; E347-K351 WeakPolarHBondContact O-CG 3.18Å; E347-K351 PolarHBondContact O-N 2.92Å; E347-K351 IonicContact OE2-NZ 2.85Å; E347-K351 PolarHBondContact OE2-NZ 3.28Å
348	A	88.6	Confident	86.9	Confident	2 Å²	2	76.9 Å²	76.9	2%	0.017	39%	0.394	C	S	.	.	H	α-helix	trans	-61.7	-39.6	-179.1	0	0	0	0	0	111.7	Y331 L334 L335 L344 K345 L352	Y331-A348 HydrophobicContact CD1-CB 3.96Å; L334-A348 HydrophobicContact CB-CB 4.31Å; L334-A348 HydrophobicContact CD1-CB 4.35Å; L335-A348 HydrophobicContact CD2-CB 4.31Å; L335-A348 HydrophobicContact CG-CB 4.2Å; L344-A348 WeakPolarHBondContact O-CB 3.44Å; L344-A348 PolarHBondContact O-N 2.7Å; K345-A348 PolarHBondContact O-N 3.03Å; A348-L352 WeakPolarHBondContact O-CB 3.41Å; A348-L352 PolarHBondContact O-N 3.05Å
349	K	89.2	Confident	87	Confident	95 Å²	95	74 Å²	74	41%	0.413	38%	0.375	S	S	.	.	H	α-helix	trans	-63.1	-40.4	174	179.2	170.2	-172.8	179.1	0	112.2	L335 K345 E347 M353 W374	L335-K349 HydrophobicContact CD2-CB 3.99Å; K345-K349 WeakPolarHBondContact O-CB 3.2Å; K345-K349 PolarHBondContact O-N 2.99Å; E347-K349 VanDerWaalsContact C-N 3.3Å; E347-K349 PolarHBondContact O-N 3.16Å; K349-M353 WeakPolarHBondContact O-CB 3.26Å; K349-M353 VanDerWaalsContact O-CG 3.26Å; K349-M353 WeakPolarHBondContact O-CG 3.33Å; K349-M353 PolarHBondContact O-N 3.37Å; K349-W374 HydrophobicContact CB-CH2 3.94Å; K349-W374 HydrophobicContact CD-CH2 3.53Å; K349-W374 HydrophobicContact CD-CZ2 3.89Å; K349-W374 HydrophobicContact CD-CZ3 4.05Å; K349-W374 HydrophobicContact CG-CH2 3.48Å; K349-W374 VanDerWaalsContact CG-CH2 3.48Å; K349-W374 HydrophobicContact CG-CZ2 4.32Å; K349-W374 HydrophobicContact CG-CZ3 3.85Å
350	T	91.6	Very high	87.1	Confident	74 Å²	74	69.9 Å²	69.9	45%	0.454	35%	0.351	S	S	.	.	H	α-helix	trans	-66.2	-54.2	179.6	-56.8	0	0	0	0	110.3	E346 E347 L352 M353 E354	E346-T350 WeakPolarHBondContact O-CB 3.27Å; E346-T350 PolarHBondContact O-N 3.37Å; E346-T350 PolarHBondContact O-OG1 2.88Å; E347-T350 PolarHBondContact O-N 3.1Å; E347-T350 VanDerWaalsContact O-N 3.14Å; T350-L352 VanDerWaalsContact C-N 3.33Å; T350-L352 PolarHBondContact O-N 3.42Å; T350-M353 PolarHBondContact O-N 3.27Å; T350-M353 VanDerWaalsContact O-N 3.12Å; T350-E354 WeakPolarHBondContact O-CG 3.37Å; T350-E354 PolarHBondContact O-N 3.46Å
351	K	91	Very high	87.4	Confident	79 Å²	79	69.1 Å²	69.1	34%	0.343	35%	0.345	S	S	.	.	H	α-helix	trans	-56.9	-43.4	176.6	-68.1	164	179.8	163.7	0	112.1	Y331 E347 E354 I355	Y331-K351 HydrophobicContact CD1-CB 4.38Å; Y331-K351 HydrophobicContact CD2-CB 4.43Å; Y331-K351 HydrophobicContact CE1-CB 4.08Å; Y331-K351 HydrophobicContact CE1-CD 3.74Å; Y331-K351 HydrophobicContact CE2-CB 4.13Å; E347-K351 WeakPolarHBondContact O-CG 3.18Å; E347-K351 PolarHBondContact O-N 2.92Å; E347-K351 IonicContact OE2-NZ 2.85Å; E347-K351 PolarHBondContact OE2-NZ 3.28Å; K351-E354 PolarHBondContact O-N 3.44Å; K351-I355 WeakPolarHBondContact O-CG1 3.49Å; K351-I355 PolarHBondContact O-N 3.15Å
352	L	89	Confident	87.4	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-47.5	175.1	179.8	65.7	0	0	0	112.3	L328 L335 A348 T350 E354 I355 V356 Y364 V368	L328-L352 HydrophobicContact CD2-CD1 3.62Å; L335-L352 HydrophobicContact CD1-CD2 3.48Å; L335-L352 VanDerWaalsContact CD1-CD2 3.48Å; A348-L352 WeakPolarHBondContact O-CB 3.41Å; A348-L352 PolarHBondContact O-N 3.05Å; T350-L352 VanDerWaalsContact C-N 3.33Å; T350-L352 PolarHBondContact O-N 3.42Å; L352-E354 VanDerWaalsContact C-N 3.32Å; L352-E354 PolarHBondContact O-N 2.98Å; L352-I355 PolarHBondContact O-N 3.01Å; L352-V356 HydrophobicContact CD1-CG2 4.4Å; L352-V356 WeakPolarHBondContact O-CB 3.44Å; L352-V356 VanDerWaalsContact O-CG2 3.23Å; L352-V356 WeakPolarHBondContact O-CG2 3.32Å; L352-V356 PolarHBondContact O-N 3.02Å; L352-Y364 HydrophobicContact CD1-CE1 4.16Å; L352-V368 HydrophobicContact CD2-CG1 4.22Å
353	M	88.2	Confident	87.6	Confident	40 Å²	40	62.1 Å²	62.1	20%	0.197	31%	0.311	C	S	.	.	H	α-helix	trans	-69.7	-28	179.8	-72.2	-60.1	-57.5	0	0	113.1	K349 T350 K357 Y365 L380	K349-M353 WeakPolarHBondContact O-CB 3.26Å; K349-M353 VanDerWaalsContact O-CG 3.26Å; K349-M353 WeakPolarHBondContact O-CG 3.33Å; K349-M353 PolarHBondContact O-N 3.37Å; T350-M353 PolarHBondContact O-N 3.27Å; T350-M353 VanDerWaalsContact O-N 3.12Å; M353-K357 WeakPolarHBondContact O-CB 3.06Å; M353-K357 WeakPolarHBondContact O-CD 2.97Å; M353-K357 VanDerWaalsContact O-CG 3.23Å; M353-K357 WeakPolarHBondContact O-CG 3.43Å; M353-K357 PolarHBondContact O-N 3.1Å; M353-Y365 HydrophobicContact CE-CD2 4.35Å; M353-Y365 HydrophobicContact CE-CE2 3.8Å; M353-Y365 HydrophobicContact SD-CD2 4.11Å; M353-Y365 HydrophobicContact SD-CE2 3.78Å; M353-L380 HydrophobicContact CE-CD2 3.86Å
354	E	90.9	Very high	87.6	Confident	119 Å²	119	58.4 Å²	58.4	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-67	-51.9	171.8	-73	167.9	171.2	0	0	111.1	T350 K351 L352 V356 K357 L358	T350-E354 WeakPolarHBondContact O-CG 3.37Å; T350-E354 PolarHBondContact O-N 3.46Å; K351-E354 PolarHBondContact O-N 3.44Å; L352-E354 VanDerWaalsContact C-N 3.32Å; L352-E354 PolarHBondContact O-N 2.98Å; E354-V356 VanDerWaalsContact C-N 3.35Å; E354-V356 PolarHBondContact O-N 3.04Å; E354-K357 PolarHBondContact O-N 2.9Å; E354-L358 WeakPolarHBondContact O-CB 3.25Å; E354-L358 PolarHBondContact O-N 3.32Å
355	I	86.8	Confident	87.6	Confident	31 Å²	31	55.3 Å²	55.3	16%	0.159	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-40.9	179.2	-58.8	162.5	0	0	0	111	P325 L328 Y331 K351 L352 K357 L358 N359 M361	P325-I355 HydrophobicContact CG-CG2 4.25Å; L328-I355 HydrophobicContact CD1-CG2 4.45Å; L328-I355 HydrophobicContact CD2-CB 3.89Å; L328-I355 HydrophobicContact CD2-CD1 4.19Å; L328-I355 HydrophobicContact CD2-CG2 3.63Å; L328-I355 HydrophobicContact CG-CG2 4.18Å; Y331-I355 HydrophobicContact CD2-CD1 4.2Å; Y331-I355 HydrophobicContact CE2-CD1 3.8Å; K351-I355 WeakPolarHBondContact O-CG1 3.49Å; K351-I355 PolarHBondContact O-N 3.15Å; L352-I355 PolarHBondContact O-N 3.01Å; I355-K357 VanDerWaalsContact C-N 3.31Å; I355-K357 PolarHBondContact O-N 3.41Å; I355-L358 PolarHBondContact O-N 2.93Å; I355-N359 WeakPolarHBondContact O-CB 3.29Å; I355-N359 PolarHBondContact O-N 2.87Å; I355-M361 HydrophobicContact CG2-SD 4.34Å
356	V	87.7	Confident	87.7	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-40	175.9	162.2	0	0	0	0	112.1	L352 E354 Q360 M361 Y364 Y365	L352-V356 HydrophobicContact CD1-CG2 4.4Å; L352-V356 WeakPolarHBondContact O-CB 3.44Å; L352-V356 VanDerWaalsContact O-CG2 3.23Å; L352-V356 WeakPolarHBondContact O-CG2 3.32Å; L352-V356 PolarHBondContact O-N 3.02Å; E354-V356 VanDerWaalsContact C-N 3.35Å; E354-V356 PolarHBondContact O-N 3.04Å; V356-Q360 WeakPolarHBondContact O-CA 3.42Å; V356-Q360 PolarHBondContact O-N 2.92Å; V356-M361 HydrophobicContact CG1-CB 4.5Å; V356-M361 HydrophobicContact CG2-CB 4.38Å; V356-M361 PolarHBondContact O-N 3.34Å; V356-Y364 HydrophobicContact CG2-CD1 4.34Å; V356-Y365 HydrophobicContact CG1-CD2 4.15Å; V356-Y365 HydrophobicContact CG1-CG 4.22Å
357	K	87.5	Confident	87.6	Confident	127 Å²	127	51.7 Å²	51.7	55%	0.552	26%	0.257	S	S	*	.	H	α-helix	trans	-72.1	-44	176.4	-75.4	171	-178.9	178.9	0	111.9	M353 E354 I355 Q360 L380	M353-K357 WeakPolarHBondContact O-CB 3.06Å; M353-K357 WeakPolarHBondContact O-CD 2.97Å; M353-K357 VanDerWaalsContact O-CG 3.23Å; M353-K357 WeakPolarHBondContact O-CG 3.43Å; M353-K357 PolarHBondContact O-N 3.1Å; E354-K357 PolarHBondContact O-N 2.9Å; I355-K357 VanDerWaalsContact C-N 3.31Å; I355-K357 PolarHBondContact O-N 3.41Å; K357-Q360 PolarHBondContact O-N 3.37Å; K357-L380 HydrophobicContact CG-CD1 4.36Å
358	L	87	Confident	87.4	Confident	137 Å²	137	47.5 Å²	47.5	72%	0.717	24%	0.238	S	C	*	.	H	α-helix	trans	-61.1	-48.4	-179.5	-177.1	64.7	0	0	0	111.9	E354 I355	E354-L358 WeakPolarHBondContact O-CB 3.25Å; E354-L358 PolarHBondContact O-N 3.32Å; I355-L358 PolarHBondContact O-N 2.93Å
359	N	82.3	Confident	87.4	Confident	55 Å²	55	47.6 Å²	47.6	29%	0.294	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	8.7	-176.4	-66.4	-24.7	0	0	0	113.8	I355 M361	I355-N359 WeakPolarHBondContact O-CB 3.29Å; I355-N359 PolarHBondContact O-N 2.87Å; N359-M361 VanDerWaalsContact C-N 3.31Å; N359-M361 HydrophobicContact CB-CG 3.53Å; N359-M361 HydrophobicContact CB-SD 3.94Å; N359-M361 PolarHBondContact O-N 3.35Å
360	Q	84.4	Confident	87.4	Confident	66 Å²	66	50.4 Å²	50.4	31%	0.308	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	37.9	177.6	-57	-178.2	2.9	0	0	115.1	V356 K357 G362 L384 N388	V356-Q360 WeakPolarHBondContact O-CA 3.42Å; V356-Q360 PolarHBondContact O-N 2.92Å; K357-Q360 PolarHBondContact O-N 3.37Å; Q360-G362 VanDerWaalsContact C-N 3.25Å; Q360-G362 PolarHBondContact O-N 3Å; Q360-L384 HydrophobicContact CB-CD2 3.93Å; Q360-L384 HydrophobicContact CG-CD2 4.33Å; Q360-N388 PolarHBondContact O-ND2 3.24Å; Q360-N388 PolarHBondContact O-OD1 3.05Å
361	M	83	Confident	87.1	Confident	2 Å²	2	52 Å²	52	1%	0.01	25%	0.253	C	S	.	.			trans	-78.4	52.8	-162.9	-46.7	-168.9	78.1	0	0	115	L328 I355 V356 N359 Y364 Y365 S425	L328-M361 HydrophobicContact CD1-CE 3.45Å; L328-M361 VanDerWaalsContact CD1-CE 3.45Å; L328-M361 HydrophobicContact CD1-SD 3.51Å; L328-M361 VanDerWaalsContact CD1-SD 3.51Å; L328-M361 HydrophobicContact CD2-SD 4.34Å; I355-M361 HydrophobicContact CG2-SD 4.34Å; V356-M361 HydrophobicContact CG1-CB 4.5Å; V356-M361 HydrophobicContact CG2-CB 4.38Å; V356-M361 PolarHBondContact O-N 3.34Å; N359-M361 VanDerWaalsContact C-N 3.31Å; N359-M361 HydrophobicContact CB-CG 3.53Å; N359-M361 HydrophobicContact CB-SD 3.94Å; N359-M361 PolarHBondContact O-N 3.35Å; M361-Y364 HydrophobicContact CE-CD1 4.48Å; M361-Y364 PolarHBondContact O-N 3.27Å; M361-Y365 PolarHBondContact O-N 3.31Å; M361-S425 WeakPolarHBondContact CE-O 3.45Å; M361-S425 WeakPolarHBondContact CG-O 3.18Å
362	G	85	Confident	86.9	Confident	4 Å²	4	49.6 Å²	49.6	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-51.5	-57.8	-171.6	0	0	0	0	0	115	Q360 Y364 Y365 E366	Q360-G362 VanDerWaalsContact C-N 3.25Å; Q360-G362 PolarHBondContact O-N 3Å; G362-Y364 VanDerWaalsContact C-N 3.33Å; G362-Y364 PolarHBondContact O-N 3.23Å; G362-Y365 WeakPolarHBondContact O-CB 3.31Å; G362-Y365 PolarHBondContact O-N 3.42Å; G362-E366 PolarHBondContact O-N 2.74Å
363	P	87.3	Confident	86.7	Confident	43 Å²	43	58.2 Å²	58.2	28%	0.279	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-34.5	176.5	-30.9	40	0	0	0	115.1	E366 S367 I426 K428	P363-E366 PolarHBondContact O-N 3.32Å; P363-S367 PolarHBondContact O-N 2.98Å; P363-I426 HydrophobicContact CB-CG2 4.35Å; P363-I426 VanDerWaalsContact CD-CG2 3.48Å; P363-I426 WeakPolarHBondContact CD-O 3.41Å; P363-I426 HydrophobicContact CG-CG2 3.54Å; P363-K428 HydrophobicContact CB-CG 4.28Å; P363-K428 HydrophobicContact CG-CG 4.14Å
364	Y	87	Confident	86.6	Confident	15 Å²	15	59.2 Å²	59.2	6%	0.059	28%	0.283	C	S	.	.	H	α-helix	trans	-70.1	-40.3	173.8	-175.1	-112.8	0	0	0	111.9	L328 L352 V356 M361 G362 E366 S367 V368 F462	L328-Y364 HydrophobicContact CB-CE1 4.09Å; L328-Y364 HydrophobicContact CD1-CD1 4.44Å; L328-Y364 HydrophobicContact CD1-CE1 4.09Å; L328-Y364 HydrophobicContact CD2-CE1 4.15Å; L328-Y364 HydrophobicContact CG-CE1 4.37Å; L352-Y364 HydrophobicContact CD1-CE1 4.16Å; V356-Y364 HydrophobicContact CG2-CD1 4.34Å; M361-Y364 HydrophobicContact CE-CD1 4.48Å; M361-Y364 PolarHBondContact O-N 3.27Å; G362-Y364 VanDerWaalsContact C-N 3.33Å; G362-Y364 PolarHBondContact O-N 3.23Å; Y364-E366 VanDerWaalsContact C-N 3.26Å; Y364-E366 PolarHBondContact O-N 3.28Å; Y364-S367 PolarHBondContact O-N 3.36Å; Y364-S367 PolarHBondContact O-OG 3.38Å; Y364-V368 HydrophobicContact CD1-CG2 4.2Å; Y364-V368 HydrophobicContact CD2-CG2 4.24Å; Y364-V368 HydrophobicContact CE1-CG2 3.83Å; Y364-V368 HydrophobicContact CE2-CG2 3.88Å; Y364-V368 HydrophobicContact CG-CG2 4.39Å; Y364-V368 WeakPolarHBondContact O-CB 3.24Å; Y364-V368 WeakPolarHBondContact O-CG2 3.49Å; Y364-V368 PolarHBondContact O-N 3.32Å; Y364-F462 HydrophobicContact CD2-CE1 4.33Å; Y364-F462 HydrophobicContact CD2-CZ 4.5Å; Y364-F462 AromaticContact CE2-CE1 3.72Å; Y364-F462 HydrophobicContact CE2-CE1 3.72Å; Y364-F462 AromaticContact CE2-CZ 3.8Å; Y364-F462 HydrophobicContact CE2-CZ 3.8Å; Y364-F462 AromaticContact CZ-CZ 3.91Å
365	Y	87.5	Confident	86.3	Confident	15 Å²	15	59.4 Å²	59.4	6%	0.059	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-38.1	170.7	176.8	-110.2	0	0	0	111.5	M353 V356 M361 G362 C369 V376 D377 L380	M353-Y365 HydrophobicContact CE-CD2 4.35Å; M353-Y365 HydrophobicContact CE-CE2 3.8Å; M353-Y365 HydrophobicContact SD-CD2 4.11Å; M353-Y365 HydrophobicContact SD-CE2 3.78Å; V356-Y365 HydrophobicContact CG1-CD2 4.15Å; V356-Y365 HydrophobicContact CG1-CG 4.22Å; M361-Y365 PolarHBondContact O-N 3.31Å; G362-Y365 WeakPolarHBondContact O-CB 3.31Å; G362-Y365 PolarHBondContact O-N 3.42Å; Y365-C369 WeakPolarHBondContact CE2-SG 3.31Å; Y365-C369 VanDerWaalsContact CZ-SG 3.58Å; Y365-C369 VanDerWaalsContact O-CB 3.28Å; Y365-C369 WeakPolarHBondContact O-CB 3.29Å; Y365-C369 PolarHBondContact O-N 2.86Å; Y365-C369 PolarHBondContact O-SG 3.19Å; Y365-V376 HydrophobicContact CE1-CG1 4.12Å; Y365-D377 PolarHBondContact OH-N 2.92Å; Y365-L380 HydrophobicContact CE1-CD2 4.27Å; Y365-L380 HydrophobicContact CE2-CD2 4.5Å
366	E	87.8	Confident	86.2	Confident	42 Å²	42	60.8 Å²	60.8	20%	0.196	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-35.7	174.9	-73	-171	-150.7	0	0	114.3	G362 P363 Y364 K370 R381	G362-E366 PolarHBondContact O-N 2.74Å; P363-E366 PolarHBondContact O-N 3.32Å; Y364-E366 VanDerWaalsContact C-N 3.26Å; Y364-E366 PolarHBondContact O-N 3.28Å; E366-K370 WeakPolarHBondContact O-CD 3.36Å; E366-K370 VanDerWaalsContact O-CG 3.24Å; E366-K370 WeakPolarHBondContact O-CG 3.46Å; E366-K370 PolarHBondContact O-N 3.37Å; E366-R381 HydrophobicContact CG-CG 4.47Å; E366-R381 IonicContact OE1-CZ 3.29Å; E366-R381 IonicContact OE1-NE 3.49Å; E366-R381 PolarHBondContact OE1-NE 3.06Å; E366-R381 IonicContact OE1-NH2 3.64Å; E366-R381 PolarHBondContact OE1-NH2 3.01Å; E366-R381 IonicContact OE2-CZ 3Å; E366-R381 IonicContact OE2-NE 2.73Å; E366-R381 PolarHBondContact OE2-NE 3.3Å; E366-R381 IonicContact OE2-NH2 2.93Å; E366-R381 PolarHBondContact OE2-NH2 2.95Å
367	S	87.3	Confident	86.3	Confident	41 Å²	41	64.3 Å²	64.3	29%	0.287	32%	0.323	S	S	.	.	H	α-helix	trans	-71.7	-50	174.2	59.2	0	0	0	0	111	P363 Y364 C369 K370 E371	P363-S367 PolarHBondContact O-N 2.98Å; Y364-S367 PolarHBondContact O-N 3.36Å; Y364-S367 PolarHBondContact O-OG 3.38Å; S367-C369 VanDerWaalsContact C-N 3.32Å; S367-C369 PolarHBondContact O-N 2.93Å; S367-K370 WeakPolarHBondContact O-CB 3.44Å; S367-K370 PolarHBondContact O-N 3.32Å; S367-E371 WeakPolarHBondContact O-CG 3.33Å; S367-E371 PolarHBondContact O-N 3.46Å
368	V	86.9	Confident	86.3	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.03	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-39.9	-178.4	172.1	0	0	0	0	111.8	Y332 L352 Y364 K370 E371 L372	Y332-V368 HydrophobicContact CD2-CG1 4.05Å; Y332-V368 HydrophobicContact CD2-CG2 3.97Å; Y332-V368 HydrophobicContact CE2-CG1 4.42Å; Y332-V368 HydrophobicContact CE2-CG2 4.34Å; L352-V368 HydrophobicContact CD2-CG1 4.22Å; Y364-V368 HydrophobicContact CD1-CG2 4.2Å; Y364-V368 HydrophobicContact CD2-CG2 4.24Å; Y364-V368 HydrophobicContact CE1-CG2 3.83Å; Y364-V368 HydrophobicContact CE2-CG2 3.88Å; Y364-V368 HydrophobicContact CG-CG2 4.39Å; Y364-V368 WeakPolarHBondContact O-CB 3.24Å; Y364-V368 WeakPolarHBondContact O-CG2 3.49Å; Y364-V368 PolarHBondContact O-N 3.32Å; V368-K370 VanDerWaalsContact C-N 3.34Å; V368-K370 PolarHBondContact O-N 2.92Å; V368-E371 PolarHBondContact O-N 3.15Å; V368-L372 HydrophobicContact CG1-CD1 3.62Å; V368-L372 HydrophobicContact CG1-CG 4.11Å; V368-L372 WeakPolarHBondContact O-CB 3.32Å; V368-L372 WeakPolarHBondContact O-CG 3.29Å; V368-L372 PolarHBondContact O-N 3.46Å
369	C	88.1	Confident	86.4	Confident	4 Å²	4	65 Å²	65	3%	0.027	33%	0.325	C	S	.	.	H	α-helix	trans	-67.4	-31.1	176.2	-74.6	0	0	0	0	113.5	Y365 S367 K373 W374 V376	Y365-C369 WeakPolarHBondContact CE2-SG 3.31Å; Y365-C369 VanDerWaalsContact CZ-SG 3.58Å; Y365-C369 VanDerWaalsContact O-CB 3.28Å; Y365-C369 WeakPolarHBondContact O-CB 3.29Å; Y365-C369 PolarHBondContact O-N 2.86Å; Y365-C369 PolarHBondContact O-SG 3.19Å; S367-C369 VanDerWaalsContact C-N 3.32Å; S367-C369 PolarHBondContact O-N 2.93Å; C369-K373 CarbonylContact O-C 3.47Å; C369-K373 VanDerWaalsContact O-CA 3.28Å; C369-K373 WeakPolarHBondContact O-CA 3.18Å; C369-K373 PolarHBondContact O-N 3.22Å; C369-W374 PolarHBondContact O-N 3.01Å; C369-V376 HydrophobicContact CB-CG2 3.64Å
370	K	88.8	Confident	86.6	Confident	153 Å²	153	63.6 Å²	63.6	67%	0.665	32%	0.317	S	S	*	.	H	α-helix	trans	-69.4	-44.7	172.8	-70.1	166	-174	175.3	0	110.9	E366 S367 V368 K373	E366-K370 WeakPolarHBondContact O-CD 3.36Å; E366-K370 VanDerWaalsContact O-CG 3.24Å; E366-K370 WeakPolarHBondContact O-CG 3.46Å; E366-K370 PolarHBondContact O-N 3.37Å; S367-K370 WeakPolarHBondContact O-CB 3.44Å; S367-K370 PolarHBondContact O-N 3.32Å; V368-K370 VanDerWaalsContact C-N 3.34Å; V368-K370 PolarHBondContact O-N 2.92Å; K370-K373 PolarHBondContact O-N 2.94Å
371	E	86.6	Confident	86.8	Confident	108 Å²	108	65.7 Å²	65.7	51%	0.505	32%	0.322	S	S	.	.	H	α-helix	trans	-69.7	-47.1	-176.1	-68.6	165.1	151.5	0	0	112	Y332 S367 V368 K373	Y332-E371 HydrophobicContact CE2-CB 4.2Å; Y332-E371 PolarHBondContact OH-OE2 3.22Å; S367-E371 WeakPolarHBondContact O-CG 3.33Å; S367-E371 PolarHBondContact O-N 3.46Å; V368-E371 PolarHBondContact O-N 3.15Å; E371-K373 VanDerWaalsContact C-N 3.29Å; E371-K373 PolarHBondContact O-N 3.1Å
372	L	86.6	Confident	87.1	Confident	28 Å²	28	71.4 Å²	71.4	15%	0.147	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.3	176.3	-57.9	-178.1	0	0	0	113.6	Y332 L335 V368 W374	Y332-L372 HydrophobicContact CD2-CD1 4.41Å; Y332-L372 HydrophobicContact CD2-CD2 4.48Å; Y332-L372 HydrophobicContact CD2-CG 4.45Å; Y332-L372 HydrophobicContact CE2-CD2 4.08Å; Y332-L372 HydrophobicContact CE2-CG 4.14Å; L335-L372 HydrophobicContact CB-CD1 3.87Å; L335-L372 HydrophobicContact CB-CD2 4.32Å; L335-L372 HydrophobicContact CD1-CD1 4.16Å; V368-L372 HydrophobicContact CG1-CD1 3.62Å; V368-L372 HydrophobicContact CG1-CG 4.11Å; V368-L372 WeakPolarHBondContact O-CB 3.32Å; V368-L372 WeakPolarHBondContact O-CG 3.29Å; V368-L372 PolarHBondContact O-N 3.46Å; L372-W374 VanDerWaalsContact C-N 3.29Å; L372-W374 HydrophobicContact CB-CD2 4.1Å; L372-W374 HydrophobicContact CB-CG 4.08Å; L372-W374 HydrophobicContact CD1-CD2 4.25Å; L372-W374 HydrophobicContact CD1-CE3 4.35Å; L372-W374 HydrophobicContact CD1-CH2 3.88Å; L372-W374 HydrophobicContact CD1-CZ2 3.75Å; L372-W374 HydrophobicContact CD1-CZ3 4.18Å; L372-W374 PolarHBondContact O-N 3.26Å
373	K	84.9	Confident	87.5	Confident	184 Å²	184	75.5 Å²	75.5	80%	0.8	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	39.6	-179.1	-56.9	174.1	-176.5	172.5	0	113.5	C369 K370 E371	C369-K373 CarbonylContact O-C 3.47Å; C369-K373 VanDerWaalsContact O-CA 3.28Å; C369-K373 WeakPolarHBondContact O-CA 3.18Å; C369-K373 PolarHBondContact O-N 3.22Å; K370-K373 PolarHBondContact O-N 2.94Å; E371-K373 VanDerWaalsContact C-N 3.29Å; E371-K373 PolarHBondContact O-N 3.1Å
374	W	85.2	Confident	87.6	Confident	62 Å²	62	73.9 Å²	73.9	24%	0.235	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-87.1	149.9	-178.7	-74.1	1.3	0	0	0	112.4	L335 K349 C369 L372 V376	L335-W374 HydrophobicContact CD1-CH2 3.76Å; L335-W374 HydrophobicContact CD1-CZ2 4.39Å; L335-W374 HydrophobicContact CD2-CH2 3.98Å; L335-W374 HydrophobicContact CD2-CZ2 4.04Å; L335-W374 HydrophobicContact CG-CH2 4.39Å; K349-W374 HydrophobicContact CB-CH2 3.94Å; K349-W374 HydrophobicContact CD-CH2 3.53Å; K349-W374 HydrophobicContact CD-CZ2 3.89Å; K349-W374 HydrophobicContact CD-CZ3 4.05Å; K349-W374 HydrophobicContact CG-CH2 3.48Å; K349-W374 VanDerWaalsContact CG-CH2 3.48Å; K349-W374 HydrophobicContact CG-CZ2 4.32Å; K349-W374 HydrophobicContact CG-CZ3 3.85Å; C369-W374 PolarHBondContact O-N 3.01Å; L372-W374 VanDerWaalsContact C-N 3.29Å; L372-W374 HydrophobicContact CB-CD2 4.1Å; L372-W374 HydrophobicContact CB-CG 4.08Å; L372-W374 HydrophobicContact CD1-CD2 4.25Å; L372-W374 HydrophobicContact CD1-CE3 4.35Å; L372-W374 HydrophobicContact CD1-CH2 3.88Å; L372-W374 HydrophobicContact CD1-CZ2 3.75Å; L372-W374 HydrophobicContact CD1-CZ3 4.18Å; L372-W374 PolarHBondContact O-N 3.26Å; W374-V376 PolarHBondContact O-N 2.9Å
375	P	85	Confident	87.7	Confident	122 Å²	122	79.1 Å²	79.1	79%	0.792	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-63.9	120	172.7	27.2	-33.7	0	0	0	110.1	D377	P375-D377 PolarHBondContact O-N 3.47Å
376	V	85.3	Confident	87.9	Confident	61 Å²	61	84.1 Å²	84.1	37%	0.37	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-77.1	120	179.3	178.7	0	0	0	0	109.9	Y365 C369 W374 Q378 R381	Y365-V376 HydrophobicContact CE1-CG1 4.12Å; C369-V376 HydrophobicContact CB-CG2 3.64Å; W374-V376 PolarHBondContact O-N 2.9Å; V376-Q378 PolarHBondContact O-N 3.26Å; V376-R381 HydrophobicContact CG1-CB 4.43Å
377	D	88.3	Confident	88.1	Confident	77 Å²	77	83.2 Å²	83.2	41%	0.412	41%	0.407	S	S	.	.			trans	-67.9	112.8	168.9	178.9	-14	0	0	0	109.5	Y365 P375 E379 L380 R381	Y365-D377 PolarHBondContact OH-N 2.92Å; P375-D377 PolarHBondContact O-N 3.47Å; D377-E379 WeakPolarHBondContact OD1-CA 3.29Å; D377-E379 PolarHBondContact OD1-N 2.68Å; D377-L380 HydrophobicContact CB-CB 3.9Å; D377-L380 VanDerWaalsContact CG-CB 3.43Å; D377-L380 PolarHBondContact OD1-N 2.73Å; D377-L380 WeakPolarHBondContact OD2-CB 3.26Å; D377-R381 WeakPolarHBondContact O-CB 3.42Å; D377-R381 PolarHBondContact O-N 3.12Å
378	Q	88.6	Confident	88.3	Confident	123 Å²	123	81.5 Å²	81.5	58%	0.575	39%	0.394	S	S	*	.	H	α-helix	trans	-75.1	-25.3	-179.5	-67.6	-158	18.5	0	0	113.7	V376 K382	V376-Q378 PolarHBondContact O-N 3.26Å; Q378-K382 WeakPolarHBondContact O-CB 3.44Å; Q378-K382 WeakPolarHBondContact O-CD 3.43Å; Q378-K382 WeakPolarHBondContact O-CG 3.45Å; Q378-K382 PolarHBondContact O-N 2.78Å
379	E	89	Confident	88.5	Confident	155 Å²	155	84.2 Å²	84.2	72%	0.724	41%	0.409	S	S	*	.	H	α-helix	trans	-77.1	-45.1	179.1	-62	-169.6	173.7	0	0	109.8	D377 K382 T383	D377-E379 WeakPolarHBondContact OD1-CA 3.29Å; D377-E379 PolarHBondContact OD1-N 2.68Å; E379-K382 PolarHBondContact O-N 3.2Å; E379-T383 WeakPolarHBondContact O-CB 3.34Å; E379-T383 PolarHBondContact O-N 3.43Å; E379-T383 PolarHBondContact O-OG1 3.42Å
380	L	87	Confident	88.7	Confident	26 Å²	26	89.9 Å²	89.9	14%	0.136	43%	0.433	C	S	.	.	H	α-helix	trans	-58.4	-49.2	169.7	-177.3	63	0	0	0	110.8	M353 K357 Y365 D377 K382 T383 L384	M353-L380 HydrophobicContact CE-CD2 3.86Å; K357-L380 HydrophobicContact CG-CD1 4.36Å; Y365-L380 HydrophobicContact CE1-CD2 4.27Å; Y365-L380 HydrophobicContact CE2-CD2 4.5Å; D377-L380 HydrophobicContact CB-CB 3.9Å; D377-L380 VanDerWaalsContact CG-CB 3.43Å; D377-L380 PolarHBondContact OD1-N 2.73Å; D377-L380 WeakPolarHBondContact OD2-CB 3.26Å; L380-K382 PolarHBondContact O-N 2.99Å; L380-T383 PolarHBondContact O-N 3.4Å; L380-L384 HydrophobicContact CD1-CD1 4.01Å; L380-L384 HydrophobicContact CD1-CD2 4.46Å; L380-L384 HydrophobicContact CD1-CG 4Å; L380-L384 HydrophobicContact CG-CD1 3.91Å; L380-L384 HydrophobicContact CG-CG 4.26Å; L380-L384 WeakPolarHBondContact O-CB 3.24Å; L380-L384 VanDerWaalsContact O-CG 3.3Å; L380-L384 WeakPolarHBondContact O-CG 3.41Å; L380-L384 PolarHBondContact O-N 3.07Å
381	R	87.9	Confident	88.8	Confident	110 Å²	110	86.8 Å²	86.8	42%	0.415	42%	0.421	S	S	.	.	H	α-helix	trans	-57.6	-45.7	178.9	-173.9	-174.7	-176.8	-160.2	4.9	112.6	E366 V376 D377 K385	E366-R381 HydrophobicContact CG-CG 4.47Å; E366-R381 IonicContact OE1-CZ 3.29Å; E366-R381 IonicContact OE1-NE 3.49Å; E366-R381 PolarHBondContact OE1-NE 3.06Å; E366-R381 IonicContact OE1-NH2 3.64Å; E366-R381 PolarHBondContact OE1-NH2 3.01Å; E366-R381 IonicContact OE2-CZ 3Å; E366-R381 IonicContact OE2-NE 2.73Å; E366-R381 PolarHBondContact OE2-NE 3.3Å; E366-R381 IonicContact OE2-NH2 2.93Å; E366-R381 PolarHBondContact OE2-NH2 2.95Å; V376-R381 HydrophobicContact CG1-CB 4.43Å; D377-R381 WeakPolarHBondContact O-CB 3.42Å; D377-R381 PolarHBondContact O-N 3.12Å; R381-K385 WeakPolarHBondContact O-CB 3.3Å; R381-K385 PolarHBondContact O-N 3.44Å
382	K	90	Very high	89.1	Confident	121 Å²	121	83.1 Å²	83.1	53%	0.526	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-44.2	177.3	-75.3	165.8	-171.1	168.3	0	111.5	Q378 E379 L380 K385 Q386	Q378-K382 WeakPolarHBondContact O-CB 3.44Å; Q378-K382 WeakPolarHBondContact O-CD 3.43Å; Q378-K382 WeakPolarHBondContact O-CG 3.45Å; Q378-K382 PolarHBondContact O-N 2.78Å; E379-K382 PolarHBondContact O-N 3.2Å; L380-K382 PolarHBondContact O-N 2.99Å; K382-K385 PolarHBondContact O-N 2.99Å; K382-Q386 WeakPolarHBondContact O-CB 3.46Å; K382-Q386 WeakPolarHBondContact O-CG 3.27Å; K382-Q386 PolarHBondContact O-N 3.12Å
383	T	91.5	Very high	89.4	Confident	91 Å²	91	87.1 Å²	87.1	56%	0.558	42%	0.422	S	S	*	.	H	α-helix	trans	-62.5	-48.4	179	-55	0	0	0	0	111.4	E379 L380 Q386 A387	E379-T383 WeakPolarHBondContact O-CB 3.34Å; E379-T383 PolarHBondContact O-N 3.43Å; E379-T383 PolarHBondContact O-OG1 3.42Å; L380-T383 PolarHBondContact O-N 3.4Å; T383-Q386 PolarHBondContact O-N 3.22Å; T383-A387 PolarHBondContact O-N 3.48Å
384	L	89.7	Confident	89.9	Confident	9 Å²	9	82.4 Å²	82.4	5%	0.047	41%	0.405	C	S	.	.	H	α-helix	trans	-62.7	-43.6	177.6	-68.8	-178.1	0	0	0	112.2	Q360 L380 A387 N388	Q360-L384 HydrophobicContact CB-CD2 3.93Å; Q360-L384 HydrophobicContact CG-CD2 4.33Å; L380-L384 HydrophobicContact CD1-CD1 4.01Å; L380-L384 HydrophobicContact CD1-CD2 4.46Å; L380-L384 HydrophobicContact CD1-CG 4Å; L380-L384 HydrophobicContact CG-CD1 3.91Å; L380-L384 HydrophobicContact CG-CG 4.26Å; L380-L384 WeakPolarHBondContact O-CB 3.24Å; L380-L384 VanDerWaalsContact O-CG 3.3Å; L380-L384 WeakPolarHBondContact O-CG 3.41Å; L380-L384 PolarHBondContact O-N 3.07Å; L384-A387 PolarHBondContact O-N 3.25Å; L384-N388 WeakPolarHBondContact O-CB 3.38Å; L384-N388 PolarHBondContact O-N 3.09Å; L384-N388 PolarHBondContact O-ND2 3.02Å
385	K	90.6	Very high	90.2	Very high	124 Å²	124	79.8 Å²	79.8	54%	0.539	40%	0.395	S	S	.	.	H	α-helix	trans	-60.7	-48	175.7	-178	172	179.4	-177.8	0	111.4	R381 K382 A387 N388 D389	R381-K385 WeakPolarHBondContact O-CB 3.3Å; R381-K385 PolarHBondContact O-N 3.44Å; K382-K385 PolarHBondContact O-N 2.99Å; K385-A387 VanDerWaalsContact C-N 3.31Å; K385-A387 PolarHBondContact O-N 2.85Å; K385-N388 PolarHBondContact O-N 2.87Å; K385-D389 WeakPolarHBondContact CE-OD2 3.35Å; K385-D389 VanDerWaalsContact CG-OD2 3.27Å; K385-D389 WeakPolarHBondContact CG-OD2 3.22Å; K385-D389 WeakPolarHBondContact O-CB 3.26Å; K385-D389 VanDerWaalsContact O-CG 3.24Å; K385-D389 PolarHBondContact O-N 3.08Å
386	Q	91.3	Very high	90.7	Very high	120 Å²	120	76.7 Å²	76.7	56%	0.561	37%	0.372	S	S	*	.	H	α-helix	trans	-63.5	-32	179.5	-73.9	-177.9	11.3	0	0	113.9	K382 T383 K390	K382-Q386 WeakPolarHBondContact O-CB 3.46Å; K382-Q386 WeakPolarHBondContact O-CG 3.27Å; K382-Q386 PolarHBondContact O-N 3.12Å; T383-Q386 PolarHBondContact O-N 3.22Å; Q386-K390 VanDerWaalsContact O-CD 3.27Å; Q386-K390 WeakPolarHBondContact O-CD 3.41Å; Q386-K390 WeakPolarHBondContact O-CG 3.26Å
387	A	90.8	Very high	91.1	Very high	23 Å²	23	79.4 Å²	79.4	19%	0.19	38%	0.381	C	S	.	.	H	α-helix	trans	-70.6	-49.5	173.9	0	0	0	0	0	110.9	T383 L384 K385 D389 K390 H391	T383-A387 PolarHBondContact O-N 3.48Å; L384-A387 PolarHBondContact O-N 3.25Å; K385-A387 VanDerWaalsContact C-N 3.31Å; K385-A387 PolarHBondContact O-N 2.85Å; A387-D389 PolarHBondContact O-N 3.01Å; A387-K390 PolarHBondContact O-N 3.29Å; A387-H391 PolarHBondContact O-CD2 2.99Å; A387-H391 PolarHBondContact O-N 3.3Å; A387-H391 VanDerWaalsContact O-N 3.1Å
388	N	91.4	Very high	91.3	Very high	5 Å²	5	79.5 Å²	79.5	3%	0.027	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-42.5	-178.3	-69.5	-21.4	0	0	0	112.7	Q360 L384 K385 K390 H391 I392 Y422 I426	Q360-N388 PolarHBondContact O-ND2 3.24Å; Q360-N388 PolarHBondContact O-OD1 3.05Å; L384-N388 WeakPolarHBondContact O-CB 3.38Å; L384-N388 PolarHBondContact O-N 3.09Å; L384-N388 PolarHBondContact O-ND2 3.02Å; K385-N388 PolarHBondContact O-N 2.87Å; N388-K390 VanDerWaalsContact C-N 3.33Å; N388-K390 PolarHBondContact O-N 2.77Å; N388-H391 PolarHBondContact O-N 3.41Å; N388-I392 WeakPolarHBondContact O-CB 3.37Å; N388-I392 VanDerWaalsContact O-CG1 3.26Å; N388-I392 WeakPolarHBondContact O-CG1 3.27Å; N388-I392 PolarHBondContact O-N 3.27Å; N388-Y422 PolarHBondContact OD1-OH 3.45Å; N388-I426 HydrophobicContact CB-CD1 3.85Å; N388-I426 HydrophobicContact CB-CG1 4.4Å
389	D	91.7	Very high	91.4	Very high	63 Å²	63	74.4 Å²	74.4	34%	0.337	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-40	178.1	-68.8	-17.2	0	0	0	111.2	K385 A387 Q393	K385-D389 WeakPolarHBondContact CE-OD2 3.35Å; K385-D389 VanDerWaalsContact CG-OD2 3.27Å; K385-D389 WeakPolarHBondContact CG-OD2 3.22Å; K385-D389 WeakPolarHBondContact O-CB 3.26Å; K385-D389 VanDerWaalsContact O-CG 3.24Å; K385-D389 PolarHBondContact O-N 3.08Å; A387-D389 PolarHBondContact O-N 3.01Å; D389-Q393 WeakPolarHBondContact O-CB 3.27Å; D389-Q393 WeakPolarHBondContact O-CG 3.49Å; D389-Q393 PolarHBondContact O-N 2.97Å
390	K	92.8	Very high	91.5	Very high	122 Å²	122	71.3 Å²	71.3	53%	0.53	34%	0.342	S	S	.	.	H	α-helix	trans	-65.1	-45.7	175.9	-71.9	168.8	-172.3	172.3	0	112.7	Q386 A387 N388 Q393 I394	Q386-K390 VanDerWaalsContact O-CD 3.27Å; Q386-K390 WeakPolarHBondContact O-CD 3.41Å; Q386-K390 WeakPolarHBondContact O-CG 3.26Å; A387-K390 PolarHBondContact O-N 3.29Å; N388-K390 VanDerWaalsContact C-N 3.33Å; N388-K390 PolarHBondContact O-N 2.77Å; K390-Q393 WeakPolarHBondContact O-CB 3.25Å; K390-Q393 PolarHBondContact O-N 2.76Å; K390-I394 WeakPolarHBondContact O-CG1 3.35Å; K390-I394 PolarHBondContact O-N 2.6Å
391	H	91.4	Very high	91.7	Very high	88 Å²	88	75.4 Å²	75.4	41%	0.407	36%	0.363	S	S	.	.	H	α-helix	trans	-67.7	-37.9	178.4	-82	-81.7	0	0	0	111.9	A387 N388 Q393 I394 L395 Y422	A387-H391 PolarHBondContact O-CD2 2.99Å; A387-H391 PolarHBondContact O-N 3.3Å; A387-H391 VanDerWaalsContact O-N 3.1Å; N388-H391 PolarHBondContact O-N 3.41Å; H391-Q393 VanDerWaalsContact C-N 3.33Å; H391-Q393 PolarHBondContact O-N 3.32Å; H391-I394 PolarHBondContact O-N 2.93Å; H391-L395 WeakPolarHBondContact O-CD1 3.41Å; H391-L395 VanDerWaalsContact O-CG 3.32Å; H391-L395 WeakPolarHBondContact O-CG 3.27Å; H391-L395 PolarHBondContact O-N 2.98Å; H391-Y422 HydrophobicContact CB-CD1 4.29Å; H391-Y422 HydrophobicContact CB-CE1 3.3Å; H391-Y422 HydrophobicContact CB-CE2 4.43Å; H391-Y422 VanDerWaalsContact CB-CZ 3.42Å; H391-Y422 VanDerWaalsContact CB-OH 3.25Å; H391-Y422 WeakPolarHBondContact CB-OH 3.34Å; H391-Y422 AromaticContact CG-CZ 3.97Å
392	I	92.3	Very high	91.7	Very high	32 Å²	32	70.5 Å²	70.5	16%	0.164	35%	0.347	C	S	.	.	H	α-helix	trans	-61.9	-40.5	172.5	-70.6	167.8	0	0	0	110.9	N388 L395 N396 Y422 L423 I426	N388-I392 WeakPolarHBondContact O-CB 3.37Å; N388-I392 VanDerWaalsContact O-CG1 3.26Å; N388-I392 WeakPolarHBondContact O-CG1 3.27Å; N388-I392 PolarHBondContact O-N 3.27Å; I392-L395 PolarHBondContact O-N 3.4Å; I392-N396 WeakPolarHBondContact O-CB 3.12Å; I392-N396 VanDerWaalsContact O-CG 3.23Å; I392-N396 PolarHBondContact O-N 3.35Å; I392-N396 PolarHBondContact O-ND2 3.48Å; I392-Y422 HydrophobicContact CG1-CD1 4.41Å; I392-Y422 HydrophobicContact CG1-CE1 4.14Å; I392-L423 HydrophobicContact CD1-CD2 4.4Å; I392-I426 HydrophobicContact CD1-CD1 3.98Å; I392-I426 HydrophobicContact CG1-CD1 4.26Å
393	Q	93.8	Very high	91.6	Very high	112 Å²	112	66.6 Å²	66.6	52%	0.523	33%	0.33	S	S	.	.	H	α-helix	trans	-59.9	-51.2	173.9	-74.9	163.3	0.3	0	0	111.5	D389 K390 H391 L395 N396 E397	D389-Q393 WeakPolarHBondContact O-CB 3.27Å; D389-Q393 WeakPolarHBondContact O-CG 3.49Å; D389-Q393 PolarHBondContact O-N 2.97Å; K390-Q393 WeakPolarHBondContact O-CB 3.25Å; K390-Q393 PolarHBondContact O-N 2.76Å; H391-Q393 VanDerWaalsContact C-N 3.33Å; H391-Q393 PolarHBondContact O-N 3.32Å; Q393-L395 VanDerWaalsContact C-N 3.3Å; Q393-L395 PolarHBondContact O-N 2.97Å; Q393-N396 PolarHBondContact O-N 3.22Å; Q393-N396 VanDerWaalsContact O-N 3.11Å; Q393-E397 WeakPolarHBondContact O-CG 3.47Å; Q393-E397 PolarHBondContact O-N 3.42Å
394	I	94.1	Very high	91.5	Very high	84 Å²	84	70.1 Å²	70.1	43%	0.431	34%	0.337	S	S	.	.	H	α-helix	trans	-56.9	-41.9	177.4	-67.5	162.3	0	0	0	111.8	K390 H391 E397 K398	K390-I394 WeakPolarHBondContact O-CG1 3.35Å; K390-I394 PolarHBondContact O-N 2.6Å; H391-I394 PolarHBondContact O-N 2.93Å; I394-E397 PolarHBondContact O-N 3.47Å; I394-K398 WeakPolarHBondContact O-CG 3.41Å; I394-K398 PolarHBondContact O-N 2.88Å
395	L	92.3	Very high	91.3	Very high	7 Å²	7	74.8 Å²	74.8	4%	0.037	37%	0.366	C	S	.	.	H	α-helix	trans	-67.6	-38.6	177.4	-72.3	162.5	0	0	0	112.5	H391 I392 Q393 K398 L399 E418 Y422	H391-L395 WeakPolarHBondContact O-CD1 3.41Å; H391-L395 VanDerWaalsContact O-CG 3.32Å; H391-L395 WeakPolarHBondContact O-CG 3.27Å; H391-L395 PolarHBondContact O-N 2.98Å; I392-L395 PolarHBondContact O-N 3.4Å; Q393-L395 VanDerWaalsContact C-N 3.3Å; Q393-L395 PolarHBondContact O-N 2.97Å; L395-K398 HydrophobicContact CD2-CD 4.37Å; L395-L399 WeakPolarHBondContact O-CB 3.32Å; L395-L399 PolarHBondContact O-N 3.03Å; L395-E418 HydrophobicContact CD2-CB 4.19Å; L395-E418 VanDerWaalsContact CD2-CD 3.43Å; L395-E418 HydrophobicContact CD2-CG 3.72Å; L395-E418 WeakPolarHBondContact CD2-OE1 3.38Å; L395-Y422 HydrophobicContact CD1-CD1 3.4Å; L395-Y422 HydrophobicContact CD1-CE1 4.23Å; L395-Y422 HydrophobicContact CD1-CG 3.93Å
396	N	94	Very high	90.7	Very high	57 Å²	57	79.9 Å²	79.9	31%	0.305	38%	0.382	S	S	.	.	H	α-helix	trans	-67.8	-38.2	173.9	-72.1	-23.9	0	0	0	111.7	I392 Q393 L399 L400 K419	I392-N396 WeakPolarHBondContact O-CB 3.12Å; I392-N396 VanDerWaalsContact O-CG 3.23Å; I392-N396 PolarHBondContact O-N 3.35Å; I392-N396 PolarHBondContact O-ND2 3.48Å; Q393-N396 PolarHBondContact O-N 3.22Å; Q393-N396 VanDerWaalsContact O-N 3.11Å; N396-L399 PolarHBondContact O-N 2.75Å; N396-L400 WeakPolarHBondContact O-CB 3.47Å; N396-L400 VanDerWaalsContact O-CG 3.29Å; N396-L400 WeakPolarHBondContact O-CG 3.48Å; N396-L400 PolarHBondContact O-N 2.75Å; N396-K419 PolarHBondContact OD1-NZ 3.45Å
397	E	94.1	Very high	90	Very high	118 Å²	118	76.1 Å²	76.1	55%	0.551	37%	0.367	S	S	*	.	H	α-helix	trans	-64.7	-47.3	174.4	-74.1	176.1	-173.7	0	0	111.8	Q393 I394 L399 L400 L401	Q393-E397 WeakPolarHBondContact O-CG 3.47Å; Q393-E397 PolarHBondContact O-N 3.42Å; I394-E397 PolarHBondContact O-N 3.47Å; E397-L399 VanDerWaalsContact C-N 3.28Å; E397-L399 PolarHBondContact O-N 3.18Å; E397-L400 PolarHBondContact O-N 3.45Å; E397-L401 WeakPolarHBondContact O-CB 3.46Å; E397-L401 VanDerWaalsContact O-CG 3.31Å; E397-L401 WeakPolarHBondContact O-CG 3.29Å; E397-L401 PolarHBondContact O-N 2.79Å
398	K	92.8	Very high	89.6	Confident	80 Å²	80	77.3 Å²	77.3	35%	0.348	38%	0.382	S	S	.	.	H	α-helix	trans	-50.9	-47.9	170.5	-78.8	176.2	169.5	-168.5	0	111.5	I394 L395 L401 A402 I415 E418	I394-K398 WeakPolarHBondContact O-CG 3.41Å; I394-K398 PolarHBondContact O-N 2.88Å; L395-K398 HydrophobicContact CD2-CD 4.37Å; K398-L401 PolarHBondContact O-N 3.19Å; K398-A402 WeakPolarHBondContact O-CB 3.47Å; K398-A402 PolarHBondContact O-N 3.35Å; K398-I415 HydrophobicContact CB-CG2 4.07Å; K398-E418 IonicContact NZ-OE1 3.26Å; K398-E418 PolarHBondContact NZ-OE1 3.4Å; K398-E418 IonicContact NZ-OE2 2.69Å; K398-E418 PolarHBondContact NZ-OE2 3.01Å
399	L	91.3	Very high	89.4	Confident	16 Å²	16	79.3 Å²	79.3	8%	0.084	40%	0.397	C	S	.	.	H	α-helix	trans	-65.6	-43.8	-179	-172.4	160.7	0	0	0	111.7	L395 N396 E397 A402 K403 L412 I415 L416 K419	L395-L399 WeakPolarHBondContact O-CB 3.32Å; L395-L399 PolarHBondContact O-N 3.03Å; N396-L399 PolarHBondContact O-N 2.75Å; E397-L399 VanDerWaalsContact C-N 3.28Å; E397-L399 PolarHBondContact O-N 3.18Å; L399-A402 PolarHBondContact O-N 3.46Å; L399-K403 HydrophobicContact CD2-CD 3.98Å; L399-K403 HydrophobicContact CD2-CG 4.31Å; L399-K403 PolarHBondContact O-N 2.83Å; L399-L412 HydrophobicContact CG-CD1 4.4Å; L399-I415 HydrophobicContact CB-CG2 3.96Å; L399-L416 HydrophobicContact CD1-CD2 3.74Å; L399-L416 HydrophobicContact CD1-CG 4.43Å; L399-K419 HydrophobicContact CD1-CD 4.34Å
400	L	90.7	Very high	89.2	Confident	90 Å²	90	79.9 Å²	79.9	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-65.6	-39.9	176.5	-74.5	170.8	0	0	0	112.4	N396 E397 K404	N396-L400 WeakPolarHBondContact O-CB 3.47Å; N396-L400 VanDerWaalsContact O-CG 3.29Å; N396-L400 WeakPolarHBondContact O-CG 3.48Å; N396-L400 PolarHBondContact O-N 2.75Å; E397-L400 PolarHBondContact O-N 3.45Å; L400-K404 WeakPolarHBondContact O-CB 3.48Å; L400-K404 VanDerWaalsContact O-CG 3.22Å; L400-K404 WeakPolarHBondContact O-CG 3.48Å; L400-K404 PolarHBondContact O-N 3.16Å
401	L	90.7	Very high	89.1	Confident	111 Å²	111	80.7 Å²	80.7	58%	0.581	40%	0.403	S	S	*	.	H	α-helix	trans	-63.5	-47.4	173.1	-71.4	169.8	0	0	0	110.8	E397 K398 K403 K404 T405	E397-L401 WeakPolarHBondContact O-CB 3.46Å; E397-L401 VanDerWaalsContact O-CG 3.31Å; E397-L401 WeakPolarHBondContact O-CG 3.29Å; E397-L401 PolarHBondContact O-N 2.79Å; K398-L401 PolarHBondContact O-N 3.19Å; L401-K403 VanDerWaalsContact C-N 3.34Å; L401-K403 PolarHBondContact O-N 2.83Å; L401-K404 PolarHBondContact O-N 3.33Å; L401-T405 PolarHBondContact O-N 3.06Å; L401-T405 PolarHBondContact O-OG1 3.34Å
402	A	89.3	Confident	89.1	Confident	8 Å²	8	77.4 Å²	77.4	7%	0.066	39%	0.388	C	S	.	.	H	α-helix	trans	-58.2	-44.4	178.3	0	0	0	0	0	112.3	K398 L399 R406 T407 I415	K398-A402 WeakPolarHBondContact O-CB 3.47Å; K398-A402 PolarHBondContact O-N 3.35Å; L399-A402 PolarHBondContact O-N 3.46Å; A402-R406 PolarHBondContact O-N 3.12Å; A402-T407 WeakPolarHBondContact CA-OG1 3.46Å; A402-T407 VanDerWaalsContact O-CB 3.28Å; A402-T407 WeakPolarHBondContact O-CB 3.23Å; A402-T407 PolarHBondContact O-N 3.49Å; A402-T407 PolarHBondContact O-OG1 3.11Å; A402-I415 HydrophobicContact CB-CD1 3.59Å
403	K	87.6	Confident	89.1	Confident	39 Å²	39	77.6 Å²	77.6	17%	0.17	39%	0.387	C	S	.	.	H	α-helix	trans	-60	-52	172.1	-78.7	-171.2	168.2	-162.1	0	112	M51 L399 L401 T405 R406 L412	M51-K403 HydrophobicContact CE-CB 4.47Å; M51-K403 HydrophobicContact CE-CD 3.89Å; M51-K403 HydrophobicContact CE-CG 4.03Å; M51-K403 HydrophobicContact SD-CD 4.18Å; M51-K403 HydrophobicContact SD-CG 4.31Å; L399-K403 HydrophobicContact CD2-CD 3.98Å; L399-K403 HydrophobicContact CD2-CG 4.31Å; L399-K403 PolarHBondContact O-N 2.83Å; L401-K403 VanDerWaalsContact C-N 3.34Å; L401-K403 PolarHBondContact O-N 2.83Å; K403-T405 PolarHBondContact O-N 3.08Å; K403-R406 PolarHBondContact O-N 3.2Å; K403-L412 HydrophobicContact CG-CD1 4.34Å
404	K	88.4	Confident	89.1	Confident	165 Å²	165	75.7 Å²	75.7	72%	0.717	39%	0.386	S	S	*	.	H	α-helix	trans	-59.8	-42.1	-177.4	-77.7	171.8	-179.6	179.6	0	113.1	L400 L401 R406	L400-K404 WeakPolarHBondContact O-CB 3.48Å; L400-K404 VanDerWaalsContact O-CG 3.22Å; L400-K404 WeakPolarHBondContact O-CG 3.48Å; L400-K404 PolarHBondContact O-N 3.16Å; L401-K404 PolarHBondContact O-N 3.33Å; K404-R406 PolarHBondContact O-N 3.42Å
405	T	86.4	Confident	89	Confident	107 Å²	107	73 Å²	73	66%	0.656	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	0.7	178.5	-56.2	0	0	0	0	112.9	L401 K403 T407	L401-T405 PolarHBondContact O-N 3.06Å; L401-T405 PolarHBondContact O-OG1 3.34Å; K403-T405 PolarHBondContact O-N 3.08Å; T405-T407 PolarHBondContact O-N 3.46Å
406	R	78	Confident	89.1	Confident	230 Å²	230	72.9 Å²	72.9	87%	0.868	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	43.6	-172.1	-66.5	-175.8	168.8	-163.5	-7	111.8	A402 K403 K404	A402-R406 PolarHBondContact O-N 3.12Å; K403-R406 PolarHBondContact O-N 3.2Å; K404-R406 PolarHBondContact O-N 3.42Å
407	T	75.8	Confident	89.1	Confident	41 Å²	41	71.5 Å²	71.5	25%	0.252	36%	0.364	S	S	.	.			trans	-66.4	137.1	-177	-44.1	0	0	0	0	109.7	A402 T405 K411	A402-T407 WeakPolarHBondContact CA-OG1 3.46Å; A402-T407 VanDerWaalsContact O-CB 3.28Å; A402-T407 WeakPolarHBondContact O-CB 3.23Å; A402-T407 PolarHBondContact O-N 3.49Å; A402-T407 PolarHBondContact O-OG1 3.11Å; T405-T407 PolarHBondContact O-N 3.46Å; T407-K411 HydrophobicContact CG2-CB 3.69Å; T407-K411 HydrophobicContact CG2-CD 3.61Å; T407-K411 HydrophobicContact CG2-CG 3.88Å
408	G	84	Confident	89	Confident	49 Å²	49	69.9 Å²	69.9	51%	0.505	36%	0.357	S	S	.	.			trans	-51.4	146.4	-176.6	0	0	0	0	0	113.9	D410 K411 L412	G408-D410 PolarHBondContact O-N 2.94Å; G408-D410 VanDerWaalsContact O-N 3.07Å; G408-K411 PolarHBondContact O-N 3.47Å; G408-L412 PolarHBondContact O-N 3.37Å
409	S	86.6	Confident	89	Confident	47 Å²	47	68.2 Å²	68.2	33%	0.329	35%	0.349	S	S	.	.	H	α-helix	trans	-49.9	-37.5	-171.1	48.6	0	0	0	0	114	K411 L412 R413	S409-K411 VanDerWaalsContact C-N 3.32Å; S409-K411 PolarHBondContact O-N 2.93Å; S409-L412 PolarHBondContact O-N 3.26Å; S409-R413 VanDerWaalsContact O-CB 3.29Å; S409-R413 WeakPolarHBondContact O-CB 3.37Å; S409-R413 PolarHBondContact O-N 3.18Å
410	D	87.8	Confident	89.1	Confident	74 Å²	74	67.4 Å²	67.4	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-36.1	175.5	-91	-55.9	0	0	0	114.2	G408 R413 S414 R448	G408-D410 PolarHBondContact O-N 2.94Å; G408-D410 VanDerWaalsContact O-N 3.07Å; D410-R413 IonicContact OD1-CZ 3.76Å; D410-R413 VanDerWaalsContact OD1-CZ 3.26Å; D410-R413 IonicContact OD1-NE 3.86Å; D410-R413 PolarHBondContact OD1-NE 3.28Å; D410-R413 IonicContact OD1-NH2 3.38Å; D410-R413 PolarHBondContact OD1-NH2 3.39Å; D410-S414 WeakPolarHBondContact O-CB 3.43Å; D410-S414 PolarHBondContact O-N 2.92Å; D410-R448 IonicContact OD1-NH1 2.92Å; D410-R448 PolarHBondContact OD1-NH1 3.29Å
411	K	90.4	Very high	89.1	Confident	140 Å²	140	64.1 Å²	64.1	61%	0.609	33%	0.33	S	S	*	.	H	α-helix	trans	-76.6	-37	176.9	-52.2	-153.6	-163	-179.8	0	111.4	T407 G408 S409 S414 I415	T407-K411 HydrophobicContact CG2-CB 3.69Å; T407-K411 HydrophobicContact CG2-CD 3.61Å; T407-K411 HydrophobicContact CG2-CG 3.88Å; G408-K411 PolarHBondContact O-N 3.47Å; S409-K411 VanDerWaalsContact C-N 3.32Å; S409-K411 PolarHBondContact O-N 2.93Å; K411-S414 PolarHBondContact O-N 3.28Å; K411-I415 WeakPolarHBondContact O-CG1 3.3Å; K411-I415 PolarHBondContact O-N 3.29Å
412	L	91.9	Very high	89.2	Confident	18 Å²	18	60.7 Å²	60.7	9%	0.094	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-45.8	173.2	-179.9	61.7	0	0	0	110.8	L399 K403 G408 S409 S414 I415 L416 L442	L399-L412 HydrophobicContact CG-CD1 4.4Å; K403-L412 HydrophobicContact CG-CD1 4.34Å; G408-L412 PolarHBondContact O-N 3.37Å; S409-L412 PolarHBondContact O-N 3.26Å; L412-S414 PolarHBondContact O-N 2.92Å; L412-I415 PolarHBondContact O-N 3.41Å; L412-L416 HydrophobicContact CD1-CD1 4.29Å; L412-L416 HydrophobicContact CG-CD1 4.01Å; L412-L416 WeakPolarHBondContact O-CB 3.42Å; L412-L416 WeakPolarHBondContact O-CG 3.48Å; L412-L416 PolarHBondContact O-N 3Å; L412-L442 HydrophobicContact CD2-CD1 3.93Å; L412-L442 HydrophobicContact CG-CD1 4.04Å
413	R	92.3	Very high	89.3	Confident	37 Å²	37	60.8 Å²	60.8	14%	0.14	31%	0.309	C	S	.	.	H	α-helix	trans	-54.6	-48.9	171.3	178.9	179.9	72.2	84.1	-0.3	111.5	S409 D410 I415 L416 L417 L442 T443	S409-R413 VanDerWaalsContact O-CB 3.29Å; S409-R413 WeakPolarHBondContact O-CB 3.37Å; S409-R413 PolarHBondContact O-N 3.18Å; D410-R413 IonicContact OD1-CZ 3.76Å; D410-R413 VanDerWaalsContact OD1-CZ 3.26Å; D410-R413 IonicContact OD1-NE 3.86Å; D410-R413 PolarHBondContact OD1-NE 3.28Å; D410-R413 IonicContact OD1-NH2 3.38Å; D410-R413 PolarHBondContact OD1-NH2 3.39Å; R413-I415 VanDerWaalsContact C-N 3.34Å; R413-I415 PolarHBondContact O-N 2.8Å; R413-L416 PolarHBondContact O-N 3.12Å; R413-L417 HydrophobicContact CG-CD1 4.2Å; R413-L417 WeakPolarHBondContact O-CG 3.48Å; R413-L417 PolarHBondContact O-N 3.35Å; R413-L442 HydrophobicContact CB-CB 4.3Å; R413-T443 VanDerWaalsContact CD-OG1 3.26Å; R413-T443 WeakPolarHBondContact CD-OG1 3.36Å
414	S	92.1	Very high	89.5	Confident	72 Å²	72	59 Å²	59	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-39.8	178.5	-167.4	0	0	0	0	113.2	D410 K411 L412 E418	D410-S414 WeakPolarHBondContact O-CB 3.43Å; D410-S414 PolarHBondContact O-N 2.92Å; K411-S414 PolarHBondContact O-N 3.28Å; L412-S414 PolarHBondContact O-N 2.92Å; S414-E418 WeakPolarHBondContact O-CB 3.12Å; S414-E418 PolarHBondContact O-N 2.97Å
415	I	93.2	Very high	89.4	Confident	27 Å²	27	52 Å²	52	14%	0.138	27%	0.273	C	S	.	.	H	α-helix	trans	-73.6	-35.1	178.7	-65.8	162.6	0	0	0	111.3	K398 L399 A402 K411 L412 R413 E418 K419	K398-I415 HydrophobicContact CB-CG2 4.07Å; L399-I415 HydrophobicContact CB-CG2 3.96Å; A402-I415 HydrophobicContact CB-CD1 3.59Å; K411-I415 WeakPolarHBondContact O-CG1 3.3Å; K411-I415 PolarHBondContact O-N 3.29Å; L412-I415 PolarHBondContact O-N 3.41Å; R413-I415 VanDerWaalsContact C-N 3.34Å; R413-I415 PolarHBondContact O-N 2.8Å; I415-E418 PolarHBondContact O-N 3.39Å; I415-K419 WeakPolarHBondContact O-CB 3.3Å; I415-K419 PolarHBondContact O-N 3.36Å
416	L	93.8	Very high	89.6	Confident	4 Å²	4	47 Å²	47	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-66.3	-39.8	173.6	-75.6	164.2	0	0	0	111.8	L399 L412 R413 K419 A420 V435 I438 A439 L442	L399-L416 HydrophobicContact CD1-CD2 3.74Å; L399-L416 HydrophobicContact CD1-CG 4.43Å; L412-L416 HydrophobicContact CD1-CD1 4.29Å; L412-L416 HydrophobicContact CG-CD1 4.01Å; L412-L416 WeakPolarHBondContact O-CB 3.42Å; L412-L416 WeakPolarHBondContact O-CG 3.48Å; L412-L416 PolarHBondContact O-N 3Å; R413-L416 PolarHBondContact O-N 3.12Å; L416-K419 PolarHBondContact O-N 3.46Å; L416-A420 VanDerWaalsContact O-CB 3.31Å; L416-A420 WeakPolarHBondContact O-CB 3.37Å; L416-A420 PolarHBondContact O-N 3.46Å; L416-V435 HydrophobicContact CD2-CG1 4.04Å; L416-V435 WeakPolarHBondContact O-CG1 3.48Å; L416-I438 HydrophobicContact CD1-CG2 4.17Å; L416-A439 HydrophobicContact CB-CB 4.01Å; L416-L442 HydrophobicContact CD1-CD1 3.43Å; L416-L442 VanDerWaalsContact CD1-CD1 3.43Å
417	L	93.1	Very high	90	Very high	29 Å²	29	36.9 Å²	36.9	15%	0.152	21%	0.21	C	C	.	.	H	α-helix	trans	-65.1	-47.3	172.3	-67.3	171.6	0	0	0	111.2	R413 K419 A420 S421 Y436 A439 V452	R413-L417 HydrophobicContact CG-CD1 4.2Å; R413-L417 WeakPolarHBondContact O-CG 3.48Å; R413-L417 PolarHBondContact O-N 3.35Å; L417-K419 PolarHBondContact O-N 2.89Å; L417-A420 PolarHBondContact O-N 3.38Å; L417-S421 PolarHBondContact O-N 3.32Å; L417-S421 PolarHBondContact O-OG 2.97Å; L417-S421 VanDerWaalsContact O-OG 3.04Å; L417-Y436 HydrophobicContact CD2-CD1 3.82Å; L417-Y436 HydrophobicContact CD2-CE1 3.79Å; L417-A439 HydrophobicContact CD2-CB 3.73Å; L417-A439 HydrophobicContact CG-CB 4.1Å; L417-V452 HydrophobicContact CD1-CG2 4.41Å; L417-V452 HydrophobicContact CD2-CG1 4.33Å; L417-V452 HydrophobicContact CD2-CG2 3.88Å
418	E	92.4	Very high	90.6	Very high	84 Å²	84	38.4 Å²	38.4	39%	0.393	21%	0.213	S	C	.	.	H	α-helix	trans	-51.6	-44.5	173.8	-165.5	-167.6	159.4	0	0	111.5	L395 K398 S414 I415 Y422	L395-E418 HydrophobicContact CD2-CB 4.19Å; L395-E418 VanDerWaalsContact CD2-CD 3.43Å; L395-E418 HydrophobicContact CD2-CG 3.72Å; L395-E418 WeakPolarHBondContact CD2-OE1 3.38Å; K398-E418 IonicContact NZ-OE1 3.26Å; K398-E418 PolarHBondContact NZ-OE1 3.4Å; K398-E418 IonicContact NZ-OE2 2.69Å; K398-E418 PolarHBondContact NZ-OE2 3.01Å; S414-E418 WeakPolarHBondContact O-CB 3.12Å; S414-E418 PolarHBondContact O-N 2.97Å; I415-E418 PolarHBondContact O-N 3.39Å; E418-Y422 WeakPolarHBondContact O-CB 3.48Å; E418-Y422 PolarHBondContact O-N 3.31Å; E418-Y422 VanDerWaalsContact O-N 3.1Å
419	K	93.2	Very high	90.9	Very high	44 Å²	44	36.8 Å²	36.8	19%	0.191	19%	0.192	C	C	.	.	H	α-helix	trans	-68	-42	175.6	179.8	174.7	173.1	174.7	0	113.1	N396 L399 I415 L416 L417 Y422 L423 V435	N396-K419 PolarHBondContact OD1-NZ 3.45Å; L399-K419 HydrophobicContact CD1-CD 4.34Å; I415-K419 WeakPolarHBondContact O-CB 3.3Å; I415-K419 PolarHBondContact O-N 3.36Å; L416-K419 PolarHBondContact O-N 3.46Å; L417-K419 PolarHBondContact O-N 2.89Å; K419-Y422 PolarHBondContact O-N 3.27Å; K419-L423 HydrophobicContact CG-CD1 4.12Å; K419-L423 WeakPolarHBondContact O-CB 3.48Å; K419-L423 WeakPolarHBondContact O-CG 3.42Å; K419-L423 PolarHBondContact O-N 3.19Å; K419-V435 HydrophobicContact CG-CG1 4.44Å
420	A	93.2	Very high	91	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.5	-44.6	-178.7	0	0	0	0	0	111.7	L416 L417 L423 C424 S432 V435 Y436	L416-A420 VanDerWaalsContact O-CB 3.31Å; L416-A420 WeakPolarHBondContact O-CB 3.37Å; L416-A420 PolarHBondContact O-N 3.46Å; L417-A420 PolarHBondContact O-N 3.38Å; A420-L423 PolarHBondContact O-N 3.24Å; A420-C424 PolarHBondContact O-N 3.39Å; A420-S432 PolarHBondContact O-OG 3.01Å; A420-V435 HydrophobicContact CB-CB 4.11Å; A420-V435 HydrophobicContact CB-CG1 3.89Å; A420-Y436 HydrophobicContact CB-CD1 3.67Å; A420-Y436 HydrophobicContact CB-CD2 3.7Å; A420-Y436 HydrophobicContact CB-CE1 3.63Å; A420-Y436 HydrophobicContact CB-CE2 3.66Å; A420-Y436 HydrophobicContact CB-CG 3.7Å
421	S	91.2	Very high	91.2	Very high	21 Å²	21	42.6 Å²	42.6	15%	0.147	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-39.5	175	-46.6	0	0	0	0	111.5	L417 C424 S425 Y436	L417-S421 PolarHBondContact O-N 3.32Å; L417-S421 PolarHBondContact O-OG 2.97Å; L417-S421 VanDerWaalsContact O-OG 3.04Å; S421-C424 WeakPolarHBondContact O-CA 3.32Å; S421-C424 VanDerWaalsContact O-CB 3.27Å; S421-C424 WeakPolarHBondContact O-CB 3.41Å; S421-C424 PolarHBondContact O-N 3.2Å; S421-C424 VanDerWaalsContact O-N 3.15Å; S421-S425 PolarHBondContact O-N 3.12Å; S421-Y436 WeakPolarHBondContact CA-OH 3.45Å; S421-Y436 PolarHBondContact N-OH 3.28Å; S421-Y436 PolarHBondContact OG-OH 3.3Å
422	Y	92.1	Very high	91.3	Very high	38 Å²	38	36 Å²	36	15%	0.149	18%	0.176	C	C	.	.	H	α-helix	trans	-68.9	-38.3	176.1	-173	-117.8	0	0	0	113.3	N388 H391 I392 L395 E418 K419 C424 S425 I426	N388-Y422 PolarHBondContact OD1-OH 3.45Å; H391-Y422 HydrophobicContact CB-CD1 4.29Å; H391-Y422 HydrophobicContact CB-CE1 3.3Å; H391-Y422 HydrophobicContact CB-CE2 4.43Å; H391-Y422 VanDerWaalsContact CB-CZ 3.42Å; H391-Y422 VanDerWaalsContact CB-OH 3.25Å; H391-Y422 WeakPolarHBondContact CB-OH 3.34Å; H391-Y422 AromaticContact CG-CZ 3.97Å; I392-Y422 HydrophobicContact CG1-CD1 4.41Å; I392-Y422 HydrophobicContact CG1-CE1 4.14Å; L395-Y422 HydrophobicContact CD1-CD1 3.4Å; L395-Y422 HydrophobicContact CD1-CE1 4.23Å; L395-Y422 HydrophobicContact CD1-CG 3.93Å; E418-Y422 WeakPolarHBondContact O-CB 3.48Å; E418-Y422 PolarHBondContact O-N 3.31Å; E418-Y422 VanDerWaalsContact O-N 3.1Å; K419-Y422 PolarHBondContact O-N 3.27Å; Y422-C424 PolarHBondContact O-N 2.74Å; Y422-S425 WeakPolarHBondContact CD2-OG 3.21Å; Y422-S425 PolarHBondContact O-N 3.38Å; Y422-S425 PolarHBondContact O-OG 3.29Å; Y422-I426 HydrophobicContact CD1-CD1 3.76Å; Y422-I426 HydrophobicContact CE1-CD1 3.3Å; Y422-I426 HydrophobicContact CE1-CG1 4.16Å; Y422-I426 HydrophobicContact CE2-CD1 4.23Å; Y422-I426 HydrophobicContact CE2-CG1 4.2Å; Y422-I426 HydrophobicContact CG-CD1 4.4Å; Y422-I426 WeakPolarHBondContact O-CB 3.5Å; Y422-I426 VanDerWaalsContact O-CG1 3.32Å; Y422-I426 WeakPolarHBondContact O-CG1 3.31Å; Y422-I426 PolarHBondContact O-N 3.49Å
423	L	92.2	Very high	91.4	Very high	11 Å²	11	36.1 Å²	36.1	6%	0.058	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-32.6	169.8	-73.8	169.5	0	0	0	111.7	I392 K419 A420 G427 K428 V435	I392-L423 HydrophobicContact CD1-CD2 4.4Å; K419-L423 HydrophobicContact CG-CD1 4.12Å; K419-L423 WeakPolarHBondContact O-CB 3.48Å; K419-L423 WeakPolarHBondContact O-CG 3.42Å; K419-L423 PolarHBondContact O-N 3.19Å; A420-L423 PolarHBondContact O-N 3.24Å; L423-G427 PolarHBondContact O-N 3.34Å; L423-K428 HydrophobicContact CB-CB 4.5Å; L423-K428 HydrophobicContact CD2-CB 4.2Å; L423-K428 HydrophobicContact CD2-CD 3.94Å; L423-K428 WeakPolarHBondContact O-CA 3.48Å; L423-K428 PolarHBondContact O-N 3.27Å; L423-V435 HydrophobicContact CD1-CG2 3.9Å
424	C	90.5	Very high	91.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.9	-46.9	174.2	-169.2	0	0	0	0	112.4	V323 P324 A420 S421 Y422 I426 G427 I459	V323-C424 HydrophobicContact CG1-CB 3.86Å; P324-C424 WeakPolarHBondContact CD-SG 3.35Å; A420-C424 PolarHBondContact O-N 3.39Å; S421-C424 WeakPolarHBondContact O-CA 3.32Å; S421-C424 VanDerWaalsContact O-CB 3.27Å; S421-C424 WeakPolarHBondContact O-CB 3.41Å; S421-C424 PolarHBondContact O-N 3.2Å; S421-C424 VanDerWaalsContact O-N 3.15Å; Y422-C424 PolarHBondContact O-N 2.74Å; C424-I426 VanDerWaalsContact C-N 3.28Å; C424-I426 PolarHBondContact O-N 2.73Å; C424-G427 WeakPolarHBondContact O-CA 3.32Å; C424-G427 PolarHBondContact O-N 3.31Å; C424-I459 HydrophobicContact CB-CD1 4.17Å
425	S	88.2	Confident	91.5	Very high	20 Å²	20	37.4 Å²	37.4	14%	0.14	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-30.9	177.6	64.8	0	0	0	0	112.9	M361 S421 Y422 G427	M361-S425 WeakPolarHBondContact CE-O 3.45Å; M361-S425 WeakPolarHBondContact CG-O 3.18Å; S421-S425 PolarHBondContact O-N 3.12Å; Y422-S425 WeakPolarHBondContact CD2-OG 3.21Å; Y422-S425 PolarHBondContact O-N 3.38Å; Y422-S425 PolarHBondContact O-OG 3.29Å; S425-G427 PolarHBondContact O-N 3.32Å
426	I	89.1	Confident	91.6	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-27.4	170.4	-75	175.7	0	0	0	112.3	P363 N388 I392 Y422 C424 K428	P363-I426 HydrophobicContact CB-CG2 4.35Å; P363-I426 VanDerWaalsContact CD-CG2 3.48Å; P363-I426 WeakPolarHBondContact CD-O 3.41Å; P363-I426 HydrophobicContact CG-CG2 3.54Å; N388-I426 HydrophobicContact CB-CD1 3.85Å; N388-I426 HydrophobicContact CB-CG1 4.4Å; I392-I426 HydrophobicContact CD1-CD1 3.98Å; I392-I426 HydrophobicContact CG1-CD1 4.26Å; Y422-I426 HydrophobicContact CD1-CD1 3.76Å; Y422-I426 HydrophobicContact CE1-CD1 3.3Å; Y422-I426 HydrophobicContact CE1-CG1 4.16Å; Y422-I426 HydrophobicContact CE2-CD1 4.23Å; Y422-I426 HydrophobicContact CE2-CG1 4.2Å; Y422-I426 HydrophobicContact CG-CD1 4.4Å; Y422-I426 WeakPolarHBondContact O-CB 3.5Å; Y422-I426 VanDerWaalsContact O-CG1 3.32Å; Y422-I426 WeakPolarHBondContact O-CG1 3.31Å; Y422-I426 PolarHBondContact O-N 3.49Å; C424-I426 VanDerWaalsContact C-N 3.28Å; C424-I426 PolarHBondContact O-N 2.73Å; I426-K428 HydrophobicContact CG2-CB 4.46Å; I426-K428 HydrophobicContact CG2-CD 4.18Å; I426-K428 HydrophobicContact CG2-CG 3.91Å
427	G	86.4	Confident	91.6	Very high	18 Å²	18	38.5 Å²	38.5	19%	0.186	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	12	-171.7	0	0	0	0	0	114.9	L423 C424 S425 L429	L423-G427 PolarHBondContact O-N 3.34Å; C424-G427 WeakPolarHBondContact O-CA 3.32Å; C424-G427 PolarHBondContact O-N 3.31Å; S425-G427 PolarHBondContact O-N 3.32Å; G427-L429 PolarHBondContact O-N 3.17Å
428	K	89.6	Confident	91.6	Very high	73 Å²	73	39 Å²	39	32%	0.317	19%	0.186	S	C	.	.			trans	-81.9	56.8	173.6	-77	-177.3	162.6	-157.5	0	111.3	P363 L423 I426 R430 Q431 S432	P363-K428 HydrophobicContact CB-CG 4.28Å; P363-K428 HydrophobicContact CG-CG 4.14Å; L423-K428 HydrophobicContact CB-CB 4.5Å; L423-K428 HydrophobicContact CD2-CB 4.2Å; L423-K428 HydrophobicContact CD2-CD 3.94Å; L423-K428 WeakPolarHBondContact O-CA 3.48Å; L423-K428 PolarHBondContact O-N 3.27Å; I426-K428 HydrophobicContact CG2-CB 4.46Å; I426-K428 HydrophobicContact CG2-CD 4.18Å; I426-K428 HydrophobicContact CG2-CG 3.91Å; K428-R430 PolarHBondContact O-N 3.08Å; K428-Q431 PolarHBondContact O-N 3.05Å; K428-S432 WeakPolarHBondContact O-CB 3.23Å; K428-S432 PolarHBondContact O-N 3.34Å
429	L	88.6	Confident	91.7	Very high	14 Å²	14	35 Å²	35	7%	0.073	17%	0.167	C	C	.	.	H	α-helix	trans	-59.9	-37.7	-164.7	-59.9	175.5	0	0	0	114.5	G427 S432 L433 I459 F462 L463	G427-L429 PolarHBondContact O-N 3.17Å; L429-S432 WeakPolarHBondContact O-CB 3.3Å; L429-S432 PolarHBondContact O-N 3.4Å; L429-L433 WeakPolarHBondContact O-CG 3.32Å; L429-L433 PolarHBondContact O-N 3.49Å; L429-I459 HydrophobicContact CB-CG2 3.97Å; L429-I459 HydrophobicContact CD2-CG2 4.18Å; L429-F462 HydrophobicContact CD1-CD1 3.4Å; L429-F462 VanDerWaalsContact CD1-CD1 3.4Å; L429-F462 HydrophobicContact CD1-CE1 3.8Å; L429-F462 HydrophobicContact CD1-CG 4.36Å; L429-L463 HydrophobicContact CB-CD1 4.19Å; L429-L463 HydrophobicContact CB-CD2 4.09Å; L429-L463 HydrophobicContact CB-CG 4.24Å; L429-L463 HydrophobicContact CD1-CD2 3.68Å; L429-L463 HydrophobicContact CD1-CG 3.97Å
430	R	90.7	Very high	91.7	Very high	174 Å²	174	33.8 Å²	33.8	66%	0.657	16%	0.163	S	C	*	.	H	α-helix	trans	-66.9	-51.6	177.4	-66.8	-179.2	-177.6	-102.4	7.9	112	K428 S432 L433 E434	K428-R430 PolarHBondContact O-N 3.08Å; R430-S432 PolarHBondContact O-N 2.83Å; R430-L433 WeakPolarHBondContact O-CB 3.48Å; R430-L433 PolarHBondContact O-N 3.03Å; R430-L433 VanDerWaalsContact O-N 3.11Å; R430-E434 PolarHBondContact O-N 2.92Å
431	Q	91.5	Very high	91.6	Very high	70 Å²	70	39.3 Å²	39.3	33%	0.327	19%	0.192	S	C	.	.	H	α-helix	trans	-62.2	-30.7	176.1	-66.7	-178.8	-19	0	0	112.1	K428 V435	K428-Q431 PolarHBondContact O-N 3.05Å; Q431-V435 WeakPolarHBondContact O-CG2 3.48Å; Q431-V435 PolarHBondContact O-N 3.4Å
432	S	92.7	Very high	91.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-44.9	172.9	180	0	0	0	0	112.1	A420 K428 L429 R430 E434 V435 Y436	A420-S432 PolarHBondContact O-OG 3.01Å; K428-S432 WeakPolarHBondContact O-CB 3.23Å; K428-S432 PolarHBondContact O-N 3.34Å; L429-S432 WeakPolarHBondContact O-CB 3.3Å; L429-S432 PolarHBondContact O-N 3.4Å; R430-S432 PolarHBondContact O-N 2.83Å; S432-E434 VanDerWaalsContact C-N 3.34Å; S432-E434 PolarHBondContact O-N 3.11Å; S432-V435 PolarHBondContact O-N 3.31Å; S432-Y436 WeakPolarHBondContact O-CD2 3.47Å; S432-Y436 PolarHBondContact O-N 2.97Å; S432-Y436 VanDerWaalsContact OG-CE2 3.3Å; S432-Y436 WeakPolarHBondContact OG-CE2 3.5Å
433	L	93.1	Very high	91.6	Very high	22 Å²	22	37.6 Å²	37.6	12%	0.115	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-42	177.8	-71.6	171.9	0	0	0	112.6	L429 R430 Y436 D437 Q456 I459 L463	L429-L433 WeakPolarHBondContact O-CG 3.32Å; L429-L433 PolarHBondContact O-N 3.49Å; R430-L433 WeakPolarHBondContact O-CB 3.48Å; R430-L433 PolarHBondContact O-N 3.03Å; R430-L433 VanDerWaalsContact O-N 3.11Å; L433-Y436 WeakPolarHBondContact O-CB 3.47Å; L433-Y436 PolarHBondContact O-N 2.93Å; L433-D437 PolarHBondContact O-N 2.68Å; L433-Q456 HydrophobicContact CD2-CB 3.81Å; L433-Q456 HydrophobicContact CD2-CG 3.91Å; L433-Q456 PolarHBondContact O-NE2 3.28Å; L433-I459 HydrophobicContact CD1-CG2 4.14Å; L433-I459 HydrophobicContact CD2-CB 3.98Å; L433-I459 HydrophobicContact CD2-CD1 4.45Å; L433-I459 HydrophobicContact CD2-CG2 3.81Å; L433-I459 HydrophobicContact CG-CG2 3.8Å; L433-L463 HydrophobicContact CD1-CD1 4.38Å
434	E	93.5	Very high	91.4	Very high	116 Å²	116	43 Å²	43	54%	0.542	21%	0.212	S	C	.	.	H	α-helix	trans	-60.9	-46.4	177.3	-67.6	157.2	-154.9	0	0	111.8	R430 S432 Y436 D437 I438	R430-E434 PolarHBondContact O-N 2.92Å; S432-E434 VanDerWaalsContact C-N 3.34Å; S432-E434 PolarHBondContact O-N 3.11Å; E434-Y436 VanDerWaalsContact C-N 3.31Å; E434-Y436 PolarHBondContact O-N 2.77Å; E434-D437 PolarHBondContact O-N 3.44Å; E434-I438 WeakPolarHBondContact O-CG1 3.21Å; E434-I438 PolarHBondContact O-N 2.93Å
435	V	94.4	Very high	91.4	Very high	19 Å²	19	44.9 Å²	44.9	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-66.8	-33.5	176.2	-177	0	0	0	0	111.2	L416 K419 A420 L423 Q431 S432 I438 A439	L416-V435 HydrophobicContact CD2-CG1 4.04Å; L416-V435 WeakPolarHBondContact O-CG1 3.48Å; K419-V435 HydrophobicContact CG-CG1 4.44Å; A420-V435 HydrophobicContact CB-CB 4.11Å; A420-V435 HydrophobicContact CB-CG1 3.89Å; L423-V435 HydrophobicContact CD1-CG2 3.9Å; Q431-V435 WeakPolarHBondContact O-CG2 3.48Å; Q431-V435 PolarHBondContact O-N 3.4Å; S432-V435 PolarHBondContact O-N 3.31Å; V435-I438 PolarHBondContact O-N 3.28Å; V435-A439 WeakPolarHBondContact O-CB 3.48Å; V435-A439 PolarHBondContact O-N 2.99Å
436	Y	94.8	Very high	91.5	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-37.2	173.5	-84.9	-61.1	0	0	0	113.6	L417 A420 S421 S432 L433 E434 A439 N440 V452 E455 Q456 I459	L417-Y436 HydrophobicContact CD2-CD1 3.82Å; L417-Y436 HydrophobicContact CD2-CE1 3.79Å; A420-Y436 HydrophobicContact CB-CD1 3.67Å; A420-Y436 HydrophobicContact CB-CD2 3.7Å; A420-Y436 HydrophobicContact CB-CE1 3.63Å; A420-Y436 HydrophobicContact CB-CE2 3.66Å; A420-Y436 HydrophobicContact CB-CG 3.7Å; S421-Y436 WeakPolarHBondContact CA-OH 3.45Å; S421-Y436 PolarHBondContact N-OH 3.28Å; S421-Y436 PolarHBondContact OG-OH 3.3Å; S432-Y436 WeakPolarHBondContact O-CD2 3.47Å; S432-Y436 PolarHBondContact O-N 2.97Å; S432-Y436 VanDerWaalsContact OG-CE2 3.3Å; S432-Y436 WeakPolarHBondContact OG-CE2 3.5Å; L433-Y436 WeakPolarHBondContact O-CB 3.47Å; L433-Y436 PolarHBondContact O-N 2.93Å; E434-Y436 VanDerWaalsContact C-N 3.31Å; E434-Y436 PolarHBondContact O-N 2.77Å; Y436-A439 PolarHBondContact O-N 3.05Å; Y436-N440 WeakPolarHBondContact O-CB 3.49Å; Y436-N440 PolarHBondContact O-N 3.43Å; Y436-V452 HydrophobicContact CD1-CG1 4.04Å; Y436-E455 HydrophobicContact CE1-CB 4.22Å; Y436-E455 VanDerWaalsContact CE1-OE2 3.23Å; Y436-E455 WeakPolarHBondContact CE1-OE2 3.37Å; Y436-E455 PolarHBondContact OH-OE2 3.22Å; Y436-Q456 HydrophobicContact CD2-CG 4.49Å; Y436-Q456 HydrophobicContact CG-CG 4.18Å; Y436-I459 HydrophobicContact CD2-CD1 3.85Å; Y436-I459 HydrophobicContact CE2-CD1 3.48Å; Y436-I459 VanDerWaalsContact CE2-CD1 3.48Å
437	D	93.7	Very high	91.6	Very high	52 Å²	52	47.3 Å²	47.3	28%	0.278	25%	0.25	S	S	.	.	H	α-helix	trans	-67.9	-39.6	175.6	-84.1	-33.6	0	0	0	110.6	L433 E434 A439 N440 D441 K453 Q456 K472	L433-D437 PolarHBondContact O-N 2.68Å; E434-D437 PolarHBondContact O-N 3.44Å; D437-A439 VanDerWaalsContact C-N 3.34Å; D437-A439 PolarHBondContact O-N 3.44Å; D437-N440 WeakPolarHBondContact O-CB 3.42Å; D437-N440 PolarHBondContact O-N 3.31Å; D437-D441 PolarHBondContact O-N 3.5Å; D437-D441 VanDerWaalsContact O-N 3.1Å; D437-K453 IonicContact OD1-NZ 2.78Å; D437-K453 PolarHBondContact OD1-NZ 2.93Å; D437-Q456 PolarHBondContact OD1-NE2 3.31Å; D437-Q456 PolarHBondContact OD1-OE1 3.34Å; D437-Q456 PolarHBondContact OD2-NE2 3.36Å; D437-K472 IonicContact OD1-NZ 2.98Å; D437-K472 PolarHBondContact OD1-NZ 3.4Å; D437-K472 IonicContact OD2-NZ 2.76Å; D437-K472 PolarHBondContact OD2-NZ 3.07Å
438	I	93.3	Very high	91.9	Very high	39 Å²	39	52.4 Å²	52.4	20%	0.2	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-40.4	171.1	-61.8	167.3	0	0	0	111.7	L54 L416 E434 V435 D441	L54-I438 HydrophobicContact CD1-CG2 3.79Å; L54-I438 HydrophobicContact CD2-CD1 4.09Å; L54-I438 HydrophobicContact CD2-CG2 4.13Å; L54-I438 HydrophobicContact CG-CD1 4.44Å; L54-I438 HydrophobicContact CG-CG2 3.94Å; L416-I438 HydrophobicContact CD1-CG2 4.17Å; E434-I438 WeakPolarHBondContact O-CG1 3.21Å; E434-I438 PolarHBondContact O-N 2.93Å; V435-I438 PolarHBondContact O-N 3.28Å; I438-D441 PolarHBondContact O-N 3.15Å
439	A	93.2	Very high	92	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.6	-36.3	176.5	0	0	0	0	0	112.3	L416 L417 V435 Y436 D437 L442 T443	L416-A439 HydrophobicContact CB-CB 4.01Å; L417-A439 HydrophobicContact CD2-CB 3.73Å; L417-A439 HydrophobicContact CG-CB 4.1Å; V435-A439 WeakPolarHBondContact O-CB 3.48Å; V435-A439 PolarHBondContact O-N 2.99Å; Y436-A439 PolarHBondContact O-N 3.05Å; D437-A439 VanDerWaalsContact C-N 3.34Å; D437-A439 PolarHBondContact O-N 3.44Å; A439-L442 PolarHBondContact O-N 2.83Å; A439-T443 PolarHBondContact O-N 3.12Å; A439-T443 PolarHBondContact O-OG1 3.03Å
440	N	93.1	Very high	92.2	Very high	19 Å²	19	52 Å²	52	10%	0.102	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-40.7	175.1	165.5	86.9	0	0	0	112.1	Y436 D437 L442 T443 V452 K453	Y436-N440 WeakPolarHBondContact O-CB 3.49Å; Y436-N440 PolarHBondContact O-N 3.43Å; D437-N440 WeakPolarHBondContact O-CB 3.42Å; D437-N440 PolarHBondContact O-N 3.31Å; N440-L442 PolarHBondContact O-N 2.92Å; N440-T443 WeakPolarHBondContact O-CA 2.95Å; N440-T443 VanDerWaalsContact O-CB 3.26Å; N440-T443 WeakPolarHBondContact O-CB 3.12Å; N440-T443 PolarHBondContact O-N 2.81Å; N440-V452 HydrophobicContact CB-CG1 4.12Å; N440-K453 VanDerWaalsContact CG-CE 3.45Å; N440-K453 VanDerWaalsContact OD1-CE 3.24Å; N440-K453 WeakPolarHBondContact OD1-CE 3.44Å
441	D	92.2	Very high	92.2	Very high	116 Å²	116	45.8 Å²	45.8	62%	0.62	24%	0.239	S	C	*	.	H	α-helix	trans	-67.4	-27.2	-178.7	-67.9	-5.9	0	0	0	112.3	D437 I438 T443	D437-D441 PolarHBondContact O-N 3.5Å; D437-D441 VanDerWaalsContact O-N 3.1Å; I438-D441 PolarHBondContact O-N 3.15Å; D441-T443 VanDerWaalsContact C-N 3.33Å
442	L	91	Very high	92.3	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.089	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.8	169.5	-65.7	168.9	0	0	0	113.6	L412 R413 L416 A439 N440	L412-L442 HydrophobicContact CD2-CD1 3.93Å; L412-L442 HydrophobicContact CG-CD1 4.04Å; R413-L442 HydrophobicContact CB-CB 4.3Å; L416-L442 HydrophobicContact CD1-CD1 3.43Å; L416-L442 VanDerWaalsContact CD1-CD1 3.43Å; A439-L442 PolarHBondContact O-N 2.83Å; N440-L442 PolarHBondContact O-N 2.92Å
443	T	91.2	Very high	92.3	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.043	23%	0.228	C	C	.	.			trans	-93.3	108.3	-173.5	-62.2	0	0	0	0	112.3	R413 A439 N440 D441 R448 R449	R413-T443 VanDerWaalsContact CD-OG1 3.26Å; R413-T443 WeakPolarHBondContact CD-OG1 3.36Å; A439-T443 PolarHBondContact O-N 3.12Å; A439-T443 PolarHBondContact O-OG1 3.03Å; N440-T443 WeakPolarHBondContact O-CA 2.95Å; N440-T443 VanDerWaalsContact O-CB 3.26Å; N440-T443 WeakPolarHBondContact O-CB 3.12Å; N440-T443 PolarHBondContact O-N 2.81Å; D441-T443 VanDerWaalsContact C-N 3.33Å; T443-R448 HydrophobicContact CG2-CB 3.49Å; T443-R448 VanDerWaalsContact CG2-CB 3.49Å; T443-R449 HydrophobicContact CG2-CG 3.77Å; T443-R449 WeakPolarHBondContact O-CD 3.23Å; T443-R449 WeakPolarHBondContact O-CG 3.49Å
444	I	89.4	Confident	92.3	Very high	125 Å²	125	42.8 Å²	42.8	64%	0.641	23%	0.225	S	C	*	.			trans	-85	137.5	176.3	-55.9	173.6	0	0	0	110.3	R448	I444-R448 WeakPolarHBondContact O-CD 3.31Å
445	G	90	Very high	92.2	Very high	38 Å²	38	38.9 Å²	38.9	39%	0.392	21%	0.207	S	C	.	.	S	Bend	trans	98	141.8	176.1	0	0	0	0	0	114.3	R449	G445-R449 WeakPolarHBondContact O-CG 3.48Å; G445-R449 PolarHBondContact O-N 2.85Å
446	A	91.2	Very high	92.2	Very high	28 Å²	28	38 Å²	38	23%	0.231	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-52.8	-176.7	0	0	0	0	0	112.4	R448 R449 M450 I479	A446-R448 VanDerWaalsContact C-N 3.35Å; A446-R448 PolarHBondContact O-N 3.34Å; A446-R449 PolarHBondContact O-N 3.23Å; A446-M450 WeakPolarHBondContact O-CB 3.32Å; A446-M450 PolarHBondContact O-N 2.93Å; A446-I479 HydrophobicContact CB-CG2 4.33Å
447	S	91.1	Very high	92.1	Very high	45 Å²	45	37.9 Å²	37.9	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-40.8	-178.9	-44.4	0	0	0	0	113.1	M450 D451	S447-M450 VanDerWaalsContact O-CB 3.32Å; S447-M450 WeakPolarHBondContact O-CB 3.25Å; S447-M450 PolarHBondContact O-N 3.18Å; S447-D451 VanDerWaalsContact O-CG 3.22Å; S447-D451 PolarHBondContact O-N 3.19Å; S447-D451 VanDerWaalsContact O-OD2 3.07Å
448	R	91.1	Very high	92	Very high	125 Å²	125	35.8 Å²	35.8	47%	0.472	19%	0.189	S	C	.	.	H	α-helix	trans	-67.6	-38.8	178.1	-67.8	-178.5	174.8	-178.7	0.8	112.2	D410 T443 I444 A446 V452	D410-R448 IonicContact OD1-NH1 2.92Å; D410-R448 PolarHBondContact OD1-NH1 3.29Å; T443-R448 HydrophobicContact CG2-CB 3.49Å; T443-R448 VanDerWaalsContact CG2-CB 3.49Å; I444-R448 WeakPolarHBondContact O-CD 3.31Å; A446-R448 VanDerWaalsContact C-N 3.35Å; A446-R448 PolarHBondContact O-N 3.34Å; R448-V452 WeakPolarHBondContact O-CG2 3.17Å; R448-V452 PolarHBondContact O-N 3.18Å
449	R	92.1	Very high	91.9	Very high	77 Å²	77	34 Å²	34	29%	0.291	18%	0.179	S	C	.	.	H	α-helix	trans	-68.3	-38.8	173.2	-68.3	-176.4	-57.7	161.1	8.8	111.8	T443 G445 A446 D451 V452 K453 I479 M482	T443-R449 HydrophobicContact CG2-CG 3.77Å; T443-R449 WeakPolarHBondContact O-CD 3.23Å; T443-R449 WeakPolarHBondContact O-CG 3.49Å; G445-R449 WeakPolarHBondContact O-CG 3.48Å; G445-R449 PolarHBondContact O-N 2.85Å; A446-R449 PolarHBondContact O-N 3.23Å; R449-D451 VanDerWaalsContact C-N 3.33Å; R449-D451 PolarHBondContact O-N 3.45Å; R449-V452 PolarHBondContact O-N 2.86Å; R449-K453 WeakPolarHBondContact O-CB 3.33Å; R449-K453 WeakPolarHBondContact O-CG 3.43Å; R449-K453 PolarHBondContact O-N 2.84Å; R449-I479 HydrophobicContact CB-CD1 4.04Å; R449-M482 PolarHBondContact NH2-SD 3.32Å; R449-M482 VanDerWaalsContact NH2-SD 3.44Å
450	M	92.8	Very high	91.9	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-54.4	-50.6	174.5	-171.5	78.3	174.6	0	0	110.6	A446 S447 V452 K453 M454 V476 I479 V484 R488 L492	A446-M450 WeakPolarHBondContact O-CB 3.32Å; A446-M450 PolarHBondContact O-N 2.93Å; S447-M450 VanDerWaalsContact O-CB 3.32Å; S447-M450 WeakPolarHBondContact O-CB 3.25Å; S447-M450 PolarHBondContact O-N 3.18Å; M450-V452 PolarHBondContact O-N 3.14Å; M450-K453 PolarHBondContact O-N 3Å; M450-M454 VanDerWaalsContact O-CG 3.23Å; M450-M454 WeakPolarHBondContact O-CG 3.33Å; M450-M454 PolarHBondContact O-N 3.29Å; M450-V476 HydrophobicContact CE-CG1 3.52Å; M450-V476 HydrophobicContact SD-CG1 3.8Å; M450-I479 HydrophobicContact CB-CG2 4Å; M450-I479 HydrophobicContact SD-CB 4.06Å; M450-I479 HydrophobicContact SD-CG2 3.93Å; M450-V484 HydrophobicContact CB-CG1 4.44Å; M450-V484 HydrophobicContact CG-CG1 4.23Å; M450-V484 HydrophobicContact SD-CG2 4.33Å; M450-R488 HydrophobicContact CG-CB 4.25Å; M450-L492 HydrophobicContact CE-CB 4.04Å; M450-L492 HydrophobicContact CE-CD2 4.09Å
451	D	91.6	Very high	91.8	Very high	44 Å²	44	33.2 Å²	33.2	24%	0.235	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-49.4	-179.6	-62	-34.4	0	0	0	111.2	S447 R449 K453 M454 E455 R488 R491	S447-D451 VanDerWaalsContact O-CG 3.22Å; S447-D451 PolarHBondContact O-N 3.19Å; S447-D451 VanDerWaalsContact O-OD2 3.07Å; R449-D451 VanDerWaalsContact C-N 3.33Å; R449-D451 PolarHBondContact O-N 3.45Å; D451-K453 PolarHBondContact O-N 3.22Å; D451-M454 WeakPolarHBondContact O-CB 3.37Å; D451-M454 PolarHBondContact O-N 3.29Å; D451-M454 VanDerWaalsContact O-N 3.16Å; D451-E455 VanDerWaalsContact O-CG 3.29Å; D451-E455 WeakPolarHBondContact O-CG 3.45Å; D451-E455 PolarHBondContact O-N 3.19Å; D451-E455 VanDerWaalsContact O-N 3.08Å; D451-R488 IonicContact OD1-CZ 2.87Å; D451-R488 IonicContact OD1-NE 2.74Å; D451-R488 PolarHBondContact OD1-NE 3.3Å; D451-R488 IonicContact OD1-NH2 3.62Å; D451-R488 IonicContact OD2-CZ 2.87Å; D451-R488 IonicContact OD2-NE 3.71Å; D451-R488 PolarHBondContact OD2-NE 3.41Å; D451-R488 IonicContact OD2-NH2 3.78Å; D451-R488 PolarHBondContact OD2-NH2 3.38Å; D451-R491 IonicContact OD1-NH1 3.23Å
452	V	93.1	Very high	91.7	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-42.1	177.5	175.9	0	0	0	0	112.6	L417 Y436 N440 R448 R449 M450 M454 E455 Q456	L417-V452 HydrophobicContact CD1-CG2 4.41Å; L417-V452 HydrophobicContact CD2-CG1 4.33Å; L417-V452 HydrophobicContact CD2-CG2 3.88Å; Y436-V452 HydrophobicContact CD1-CG1 4.04Å; N440-V452 HydrophobicContact CB-CG1 4.12Å; R448-V452 WeakPolarHBondContact O-CG2 3.17Å; R448-V452 PolarHBondContact O-N 3.18Å; R449-V452 PolarHBondContact O-N 2.86Å; M450-V452 PolarHBondContact O-N 3.14Å; V452-M454 VanDerWaalsContact C-N 3.33Å; V452-M454 PolarHBondContact O-N 2.73Å; V452-E455 WeakPolarHBondContact O-CB 3.39Å; V452-E455 PolarHBondContact O-N 2.74Å; V452-Q456 PolarHBondContact O-N 3Å; V452-Q456 VanDerWaalsContact O-N 3.12Å
453	K	93.6	Very high	91.6	Very high	13 Å²	13	30.4 Å²	30.4	6%	0.057	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-29.5	177.4	-68.1	-63	-176.4	174.4	0	112.5	D437 N440 R449 M450 D451 Q456 L457 E475 V476 I479	D437-K453 IonicContact OD1-NZ 2.78Å; D437-K453 PolarHBondContact OD1-NZ 2.93Å; N440-K453 VanDerWaalsContact CG-CE 3.45Å; N440-K453 VanDerWaalsContact OD1-CE 3.24Å; N440-K453 WeakPolarHBondContact OD1-CE 3.44Å; R449-K453 WeakPolarHBondContact O-CB 3.33Å; R449-K453 WeakPolarHBondContact O-CG 3.43Å; R449-K453 PolarHBondContact O-N 2.84Å; M450-K453 PolarHBondContact O-N 3Å; D451-K453 PolarHBondContact O-N 3.22Å; K453-Q456 PolarHBondContact O-N 2.97Å; K453-L457 WeakPolarHBondContact O-CB 3.38Å; K453-L457 PolarHBondContact O-N 3.46Å; K453-E475 WeakPolarHBondContact CE-OE2 3.35Å; K453-E475 IonicContact NZ-OE2 2.68Å; K453-E475 PolarHBondContact NZ-OE2 3.29Å; K453-V476 HydrophobicContact CB-CG2 3.58Å; K453-I479 HydrophobicContact CB-CD1 4.39Å; K453-I479 HydrophobicContact CG-CD1 3.85Å
454	M	92.5	Very high	91.3	Very high	8 Å²	8	34.6 Å²	34.6	4%	0.039	18%	0.18	C	C	.	.	H	α-helix	trans	-69.3	-31.7	170.8	-67.2	-71.8	-78.8	0	0	112	M450 D451 V452 L457 R458 V476 R491 L492 Y495	M450-M454 VanDerWaalsContact O-CG 3.23Å; M450-M454 WeakPolarHBondContact O-CG 3.33Å; M450-M454 PolarHBondContact O-N 3.29Å; D451-M454 WeakPolarHBondContact O-CB 3.37Å; D451-M454 PolarHBondContact O-N 3.29Å; D451-M454 VanDerWaalsContact O-N 3.16Å; V452-M454 VanDerWaalsContact C-N 3.33Å; V452-M454 PolarHBondContact O-N 2.73Å; M454-L457 PolarHBondContact O-N 3.09Å; M454-L457 HydrophobicContact SD-CD2 3.95Å; M454-R458 PolarHBondContact O-N 3.3Å; M454-V476 HydrophobicContact SD-CG1 3.84Å; M454-V476 HydrophobicContact SD-CG2 4.37Å; M454-R491 HydrophobicContact CE-CB 4.24Å; M454-R491 HydrophobicContact CE-CG 3.82Å; M454-L492 HydrophobicContact SD-CD1 4.4Å; M454-Y495 HydrophobicContact CE-CD1 4.15Å; M454-Y495 HydrophobicContact CE-CD2 3.42Å; M454-Y495 VanDerWaalsContact CE-CD2 3.42Å; M454-Y495 HydrophobicContact CE-CE1 4.26Å; M454-Y495 HydrophobicContact CE-CE2 3.57Å; M454-Y495 HydrophobicContact CE-CG 3.71Å
455	E	91.8	Very high	91.3	Very high	35 Å²	35	31.9 Å²	31.9	16%	0.164	17%	0.167	C	C	.	.	H	α-helix	trans	-65.8	-44.2	170.3	-47	-148.3	116	0	0	111.9	Y436 D451 V452 L457 R458 I459	Y436-E455 HydrophobicContact CE1-CB 4.22Å; Y436-E455 VanDerWaalsContact CE1-OE2 3.23Å; Y436-E455 WeakPolarHBondContact CE1-OE2 3.37Å; Y436-E455 PolarHBondContact OH-OE2 3.22Å; D451-E455 VanDerWaalsContact O-CG 3.29Å; D451-E455 WeakPolarHBondContact O-CG 3.45Å; D451-E455 PolarHBondContact O-N 3.19Å; D451-E455 VanDerWaalsContact O-N 3.08Å; V452-E455 WeakPolarHBondContact O-CB 3.39Å; V452-E455 PolarHBondContact O-N 2.74Å; E455-L457 VanDerWaalsContact C-N 3.28Å; E455-L457 PolarHBondContact O-N 3.16Å; E455-R458 WeakPolarHBondContact O-CB 3.49Å; E455-R458 PolarHBondContact O-N 2.73Å; E455-R458 IonicContact OE1-NH2 3.32Å; E455-R458 PolarHBondContact OE1-NH2 3.34Å; E455-I459 WeakPolarHBondContact O-CG1 3.46Å; E455-I459 PolarHBondContact O-N 3.01Å; E455-I459 VanDerWaalsContact O-N 3.15Å
456	Q	93.3	Very high	91.3	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-39	172	-67.5	-170.1	-36.4	0	0	112.1	L433 Y436 D437 V452 K453 I459 C460 K472	L433-Q456 HydrophobicContact CD2-CB 3.81Å; L433-Q456 HydrophobicContact CD2-CG 3.91Å; L433-Q456 PolarHBondContact O-NE2 3.28Å; Y436-Q456 HydrophobicContact CD2-CG 4.49Å; Y436-Q456 HydrophobicContact CG-CG 4.18Å; D437-Q456 PolarHBondContact OD1-NE2 3.31Å; D437-Q456 PolarHBondContact OD1-OE1 3.34Å; D437-Q456 PolarHBondContact OD2-NE2 3.36Å; V452-Q456 PolarHBondContact O-N 3Å; V452-Q456 VanDerWaalsContact O-N 3.12Å; K453-Q456 PolarHBondContact O-N 2.97Å; Q456-I459 PolarHBondContact O-N 3.47Å; Q456-C460 PolarHBondContact O-N 3.27Å; Q456-C460 PolarHBondContact O-SG 2.97Å; Q456-C460 VanDerWaalsContact O-SG 3.37Å; Q456-K472 HydrophobicContact CB-CD 4.1Å
457	L	93.3	Very high	91.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-41.5	177.8	-170.8	63.1	0	0	0	111.8	K453 M454 E455 I459 C460 M461 V469 K472 L473 Y495	K453-L457 WeakPolarHBondContact O-CB 3.38Å; K453-L457 PolarHBondContact O-N 3.46Å; M454-L457 PolarHBondContact O-N 3.09Å; M454-L457 HydrophobicContact SD-CD2 3.95Å; E455-L457 VanDerWaalsContact C-N 3.28Å; E455-L457 PolarHBondContact O-N 3.16Å; L457-I459 VanDerWaalsContact C-N 3.34Å; L457-I459 PolarHBondContact O-N 3.32Å; L457-C460 PolarHBondContact O-N 2.69Å; L457-M461 HydrophobicContact CD1-CE 4.35Å; L457-M461 HydrophobicContact CD2-CE 4.38Å; L457-M461 HydrophobicContact CG-CE 4.09Å; L457-M461 WeakPolarHBondContact O-CG 3.36Å; L457-M461 PolarHBondContact O-N 3.04Å; L457-V469 HydrophobicContact CD1-CG1 3.95Å; L457-K472 HydrophobicContact CD1-CB 4.11Å; L457-L473 HydrophobicContact CD1-CB 4.22Å; L457-L473 HydrophobicContact CD1-CD1 4.48Å; L457-L473 HydrophobicContact CD2-CD1 3.84Å; L457-Y495 HydrophobicContact CB-CD1 4.46Å; L457-Y495 HydrophobicContact CD2-CD1 3.6Å; L457-Y495 HydrophobicContact CD2-CE1 4.45Å; L457-Y495 HydrophobicContact CD2-CG 4.11Å; L457-Y495 HydrophobicContact CG-CD1 3.92Å
458	R	91	Very high	91.3	Very high	7 Å²	7	37 Å²	37	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-55.9	-47.3	170.3	-73.2	-171.7	-85.3	168.6	1.8	112	M321 V323 M454 E455 C460 M461 F462 Y495	M321-R458 PolarHBondContact O-NH1 3.29Å; V323-R458 PolarHBondContact O-NH1 2.91Å; M454-R458 PolarHBondContact O-N 3.3Å; E455-R458 WeakPolarHBondContact O-CB 3.49Å; E455-R458 PolarHBondContact O-N 2.73Å; E455-R458 IonicContact OE1-NH2 3.32Å; E455-R458 PolarHBondContact OE1-NH2 3.34Å; R458-C460 PolarHBondContact O-N 2.58Å; R458-M461 PolarHBondContact O-N 3.34Å; R458-F462 PolarHBondContact O-N 3.25Å; R458-Y495 VanDerWaalsContact CD-OH 3.29Å; R458-Y495 WeakPolarHBondContact CD-OH 3.2Å; R458-Y495 HydrophobicContact CG-CE1 3.52Å; R458-Y495 WeakPolarHBondContact CG-OH 3.38Å
459	I	92.2	Very high	91.5	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-40.6	-179.4	-67	167.9	0	0	0	111.4	P324 C424 L429 L433 Y436 E455 Q456 L457 F462 L463	P324-I459 HydrophobicContact CG-CG1 4.47Å; C424-I459 HydrophobicContact CB-CD1 4.17Å; L429-I459 HydrophobicContact CB-CG2 3.97Å; L429-I459 HydrophobicContact CD2-CG2 4.18Å; L433-I459 HydrophobicContact CD1-CG2 4.14Å; L433-I459 HydrophobicContact CD2-CB 3.98Å; L433-I459 HydrophobicContact CD2-CD1 4.45Å; L433-I459 HydrophobicContact CD2-CG2 3.81Å; L433-I459 HydrophobicContact CG-CG2 3.8Å; Y436-I459 HydrophobicContact CD2-CD1 3.85Å; Y436-I459 HydrophobicContact CE2-CD1 3.48Å; Y436-I459 VanDerWaalsContact CE2-CD1 3.48Å; E455-I459 WeakPolarHBondContact O-CG1 3.46Å; E455-I459 PolarHBondContact O-N 3.01Å; E455-I459 VanDerWaalsContact O-N 3.15Å; Q456-I459 PolarHBondContact O-N 3.47Å; L457-I459 VanDerWaalsContact C-N 3.34Å; L457-I459 PolarHBondContact O-N 3.32Å; I459-F462 PolarHBondContact O-N 3.11Å; I459-L463 HydrophobicContact CG2-CD1 4.28Å; I459-L463 WeakPolarHBondContact O-CG 3.33Å; I459-L463 PolarHBondContact O-N 2.94Å
460	C	92.4	Very high	91.6	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-37.1	174.4	-69.8	0	0	0	0	112.7	Q456 L457 R458 L463 M464 N465 L468 V469	Q456-C460 PolarHBondContact O-N 3.27Å; Q456-C460 PolarHBondContact O-SG 2.97Å; Q456-C460 VanDerWaalsContact O-SG 3.37Å; L457-C460 PolarHBondContact O-N 2.69Å; R458-C460 PolarHBondContact O-N 2.58Å; C460-L463 PolarHBondContact O-N 3.38Å; C460-M464 PolarHBondContact O-N 3.46Å; C460-N465 PolarHBondContact O-N 3.07Å; C460-L468 HydrophobicContact CB-CB 4.26Å; C460-V469 VanDerWaalsContact C-CG2 3.4Å; C460-V469 HydrophobicContact CB-CB 4.5Å; C460-V469 HydrophobicContact CB-CG2 3.66Å; C460-V469 WeakPolarHBondContact O-CG2 3.44Å
461	M	91.1	Very high	91.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-39.4	173	-71.6	-178.8	177.3	0	0	112	M326 L457 R458 L463 M464 V469 Y495 Y498 L525	M326-M461 HydrophobicContact CE-CB 4.29Å; L457-M461 HydrophobicContact CD1-CE 4.35Å; L457-M461 HydrophobicContact CD2-CE 4.38Å; L457-M461 HydrophobicContact CG-CE 4.09Å; L457-M461 WeakPolarHBondContact O-CG 3.36Å; L457-M461 PolarHBondContact O-N 3.04Å; R458-M461 PolarHBondContact O-N 3.34Å; M461-L463 VanDerWaalsContact C-N 3.3Å; M461-L463 PolarHBondContact O-N 3.18Å; M461-M464 WeakPolarHBondContact O-CA 3.26Å; M461-M464 PolarHBondContact O-N 3.11Å; M461-V469 HydrophobicContact CE-CG1 4.14Å; M461-V469 HydrophobicContact CG-CG1 4.24Å; M461-V469 HydrophobicContact CG-CG2 4.01Å; M461-Y495 HydrophobicContact CE-CD1 3.88Å; M461-Y495 HydrophobicContact CE-CG 4.36Å; M461-Y495 WeakPolarHBondContact CE-O 3.39Å; M461-Y495 HydrophobicContact SD-CD1 3.89Å; M461-Y495 HydrophobicContact SD-CE1 4.5Å; M461-Y498 HydrophobicContact SD-CD1 3.92Å; M461-Y498 HydrophobicContact SD-CE1 4.38Å; M461-L525 HydrophobicContact SD-CD1 4.15Å
462	F	90.7	Very high	91.7	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.057	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-37.9	174.3	-167.6	-77.1	0	0	0	111.6	P324 M326 L328 N329 Y364 L429 R458 I459 M464	P324-F462 HydrophobicContact CB-CD2 3.67Å; P324-F462 HydrophobicContact CB-CE2 3.88Å; P324-F462 HydrophobicContact CB-CG 4.18Å; P324-F462 HydrophobicContact CG-CB 3.83Å; P324-F462 HydrophobicContact CG-CD2 3.55Å; P324-F462 HydrophobicContact CG-CE2 4.29Å; P324-F462 HydrophobicContact CG-CG 3.79Å; M326-F462 HydrophobicContact SD-CB 4.25Å; M326-F462 HydrophobicContact SD-CD2 4Å; L328-F462 HydrophobicContact CB-CE2 4.04Å; L328-F462 HydrophobicContact CB-CZ 4.07Å; L328-F462 HydrophobicContact CD1-CE2 4.29Å; L328-F462 HydrophobicContact CD1-CZ 4.23Å; N329-F462 WeakPolarHBondContact ND2-CA 3.41Å; N329-F462 PolarHBondContact ND2-O 3.44Å; N329-F462 WeakPolarHBondContact OD1-CE1 3.47Å; N329-F462 WeakPolarHBondContact OD1-CZ 3.44Å; Y364-F462 HydrophobicContact CD2-CE1 4.33Å; Y364-F462 HydrophobicContact CD2-CZ 4.5Å; Y364-F462 AromaticContact CE2-CE1 3.72Å; Y364-F462 HydrophobicContact CE2-CE1 3.72Å; Y364-F462 AromaticContact CE2-CZ 3.8Å; Y364-F462 HydrophobicContact CE2-CZ 3.8Å; Y364-F462 AromaticContact CZ-CZ 3.91Å; L429-F462 HydrophobicContact CD1-CD1 3.4Å; L429-F462 VanDerWaalsContact CD1-CD1 3.4Å; L429-F462 HydrophobicContact CD1-CE1 3.8Å; L429-F462 HydrophobicContact CD1-CG 4.36Å; R458-F462 PolarHBondContact O-N 3.25Å; I459-F462 PolarHBondContact O-N 3.11Å; F462-M464 PolarHBondContact O-N 3.24Å
463	L	87.5	Confident	91.8	Very high	61 Å²	61	33.3 Å²	33.3	32%	0.319	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-4.2	172.4	-72.1	170.6	0	0	0	114	L429 L433 I459 C460 M461 N465	L429-L463 HydrophobicContact CB-CD1 4.19Å; L429-L463 HydrophobicContact CB-CD2 4.09Å; L429-L463 HydrophobicContact CB-CG 4.24Å; L429-L463 HydrophobicContact CD1-CD2 3.68Å; L429-L463 HydrophobicContact CD1-CG 3.97Å; L433-L463 HydrophobicContact CD1-CD1 4.38Å; I459-L463 HydrophobicContact CG2-CD1 4.28Å; I459-L463 WeakPolarHBondContact O-CG 3.33Å; I459-L463 PolarHBondContact O-N 2.94Å; C460-L463 PolarHBondContact O-N 3.38Å; M461-L463 VanDerWaalsContact C-N 3.3Å; M461-L463 PolarHBondContact O-N 3.18Å; L463-N465 PolarHBondContact O-N 2.86Å
464	M	85.9	Confident	91.8	Very high	96 Å²	96	36.4 Å²	36.4	47%	0.473	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	15.4	-177.5	-67.7	-71.5	168.5	0	0	115.1	C460 M461 F462 K466 L502	C460-M464 PolarHBondContact O-N 3.46Å; M461-M464 WeakPolarHBondContact O-CA 3.26Å; M461-M464 PolarHBondContact O-N 3.11Å; F462-M464 PolarHBondContact O-N 3.24Å; M464-K466 PolarHBondContact O-N 3.24Å; M464-L502 HydrophobicContact SD-CD2 4.47Å
465	N	88.3	Confident	91.9	Very high	67 Å²	67	38.9 Å²	38.9	36%	0.358	21%	0.209	S	C	.	.			trans	-87.6	95.1	-175	-174.5	-27.6	0	0	0	110.8	C460 L463 G467 L468 V469	C460-N465 PolarHBondContact O-N 3.07Å; L463-N465 PolarHBondContact O-N 2.86Å; N465-G467 PolarHBondContact O-N 3.34Å; N465-G467 VanDerWaalsContact O-N 3.12Å; N465-G467 PolarHBondContact OD1-N 2.96Å; N465-L468 HydrophobicContact CB-CB 4.3Å; N465-L468 HydrophobicContact CB-CD1 4.12Å; N465-L468 HydrophobicContact CB-CG 4.28Å; N465-L468 PolarHBondContact O-N 2.81Å; N465-L468 PolarHBondContact OD1-N 3.38Å; N465-V469 WeakPolarHBondContact O-CG2 3.47Å; N465-V469 PolarHBondContact O-N 2.69Å
466	K	89.9	Confident	92	Very high	105 Å²	105	37.2 Å²	37.2	46%	0.457	20%	0.201	S	C	.	.	H	α-helix	trans	-52.8	-32.2	179.9	-62.1	-174.8	172.3	-172.7	0	114.3	M464 N470 Y499 L502	M464-K466 PolarHBondContact O-N 3.24Å; K466-N470 WeakPolarHBondContact O-CB 3.49Å; K466-N470 VanDerWaalsContact O-CG 3.31Å; K466-N470 PolarHBondContact O-N 2.9Å; K466-N470 PolarHBondContact O-ND2 2.87Å; K466-Y499 HydrophobicContact CG-CE2 4.37Å; K466-Y499 PolarHBondContact O-OH 3.28Å; K466-L502 VanDerWaalsContact CE-O 3.3Å; K466-L502 WeakPolarHBondContact CE-O 3.43Å; K466-L502 PolarHBondContact NZ-O 3.02Å
467	G	91.9	Very high	92	Very high	46 Å²	46	40.4 Å²	40.4	47%	0.474	21%	0.213	S	C	.	.	H	α-helix	trans	-66.8	-47.1	176.7	0	0	0	0	0	112.4	N465 S471	N465-G467 PolarHBondContact O-N 3.34Å; N465-G467 VanDerWaalsContact O-N 3.12Å; N465-G467 PolarHBondContact OD1-N 2.96Å; G467-S471 PolarHBondContact O-N 3.22Å
468	L	92	Very high	92	Very high	67 Å²	67	44.9 Å²	44.9	35%	0.351	23%	0.234	S	C	.	.	H	α-helix	trans	-69.1	-39.1	177.2	-63.9	177.9	0	0	0	112	C460 N465 S471 K472	C460-L468 HydrophobicContact CB-CB 4.26Å; N465-L468 HydrophobicContact CB-CB 4.3Å; N465-L468 HydrophobicContact CB-CD1 4.12Å; N465-L468 HydrophobicContact CB-CG 4.28Å; N465-L468 PolarHBondContact O-N 2.81Å; N465-L468 PolarHBondContact OD1-N 3.38Å; L468-S471 PolarHBondContact O-N 3.44Å; L468-K472 PolarHBondContact O-N 3.45Å
469	V	94.4	Very high	92.1	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-46.2	175.1	178.3	0	0	0	0	110.9	L457 C460 M461 N465 S471 K472 L473 Y499	L457-V469 HydrophobicContact CD1-CG1 3.95Å; C460-V469 VanDerWaalsContact C-CG2 3.4Å; C460-V469 HydrophobicContact CB-CB 4.5Å; C460-V469 HydrophobicContact CB-CG2 3.66Å; C460-V469 WeakPolarHBondContact O-CG2 3.44Å; M461-V469 HydrophobicContact CE-CG1 4.14Å; M461-V469 HydrophobicContact CG-CG1 4.24Å; M461-V469 HydrophobicContact CG-CG2 4.01Å; N465-V469 WeakPolarHBondContact O-CG2 3.47Å; N465-V469 PolarHBondContact O-N 2.69Å; V469-S471 VanDerWaalsContact C-N 3.34Å; V469-S471 PolarHBondContact O-N 2.98Å; V469-K472 PolarHBondContact O-N 3.33Å; V469-L473 WeakPolarHBondContact O-CB 3.42Å; V469-L473 PolarHBondContact O-N 3.12Å; V469-Y499 HydrophobicContact CB-CD2 4.28Å; V469-Y499 HydrophobicContact CB-CE2 3.91Å; V469-Y499 HydrophobicContact CG1-CD1 4.38Å; V469-Y499 HydrophobicContact CG1-CD2 3.43Å; V469-Y499 VanDerWaalsContact CG1-CD2 3.43Å; V469-Y499 HydrophobicContact CG1-CE1 4.45Å; V469-Y499 HydrophobicContact CG1-CE2 3.52Å; V469-Y499 HydrophobicContact CG1-CG 3.89Å
470	N	93.7	Very high	92.1	Very high	86 Å²	86	47.3 Å²	47.3	46%	0.46	25%	0.248	S	C	.	.	H	α-helix	trans	-55.9	-45.7	174.5	-83.3	-21.1	0	0	0	112.6	K466 L473 E474 Y499	K466-N470 WeakPolarHBondContact O-CB 3.49Å; K466-N470 VanDerWaalsContact O-CG 3.31Å; K466-N470 PolarHBondContact O-N 2.9Å; K466-N470 PolarHBondContact O-ND2 2.87Å; N470-L473 PolarHBondContact O-N 3.3Å; N470-E474 PolarHBondContact O-N 3.25Å; N470-Y499 PolarHBondContact ND2-OH 3.41Å; N470-Y499 WeakPolarHBondContact OD1-CE1 3.43Å; N470-Y499 VanDerWaalsContact OD1-CZ 3.29Å; N470-Y499 PolarHBondContact OD1-OH 3.49Å
471	S	93.9	Very high	92	Very high	67 Å²	67	54 Å²	54	47%	0.469	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-52.3	-179.2	-169.6	0	0	0	0	111.6	G467 L468 V469 L473 E474 E475	G467-S471 PolarHBondContact O-N 3.22Å; L468-S471 PolarHBondContact O-N 3.44Å; V469-S471 VanDerWaalsContact C-N 3.34Å; V469-S471 PolarHBondContact O-N 2.98Å; S471-L473 VanDerWaalsContact C-N 3.27Å; S471-L473 PolarHBondContact O-N 2.96Å; S471-E474 PolarHBondContact O-N 3.22Å; S471-E475 PolarHBondContact O-N 2.98Å; S471-E475 VanDerWaalsContact O-N 3.09Å
472	K	93.9	Very high	91.9	Very high	21 Å²	21	58.3 Å²	58.3	9%	0.091	29%	0.294	C	S	.	.	H	α-helix	trans	-66.8	-29.5	-179.5	-68.3	-73.4	166.3	-171.3	0	111.9	D437 Q456 L457 L468 V469 E475 V476	D437-K472 IonicContact OD1-NZ 2.98Å; D437-K472 PolarHBondContact OD1-NZ 3.4Å; D437-K472 IonicContact OD2-NZ 2.76Å; D437-K472 PolarHBondContact OD2-NZ 3.07Å; Q456-K472 HydrophobicContact CB-CD 4.1Å; L457-K472 HydrophobicContact CD1-CB 4.11Å; L468-K472 PolarHBondContact O-N 3.45Å; V469-K472 PolarHBondContact O-N 3.33Å; K472-E475 VanDerWaalsContact CD-OE1 3.31Å; K472-E475 WeakPolarHBondContact CD-OE1 3.26Å; K472-E475 VanDerWaalsContact CE-OE1 3.31Å; K472-E475 WeakPolarHBondContact CE-OE1 3.36Å; K472-E475 IonicContact NZ-OE1 3.89Å; K472-E475 PolarHBondContact NZ-OE1 2.82Å; K472-E475 IonicContact NZ-OE2 2.6Å; K472-E475 PolarHBondContact NZ-OE2 2.76Å; K472-E475 WeakPolarHBondContact O-CB 3.2Å; K472-E475 PolarHBondContact O-N 2.88Å; K472-V476 VanDerWaalsContact O-CG2 3.25Å; K472-V476 WeakPolarHBondContact O-CG2 3.43Å; K472-V476 PolarHBondContact O-N 3.39Å
473	L	94.7	Very high	91.6	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-68.7	-36.7	175.5	-169.5	65.1	0	0	0	112.7	L457 V469 N470 S471 V476 R477 L492 E496 Y499	L457-L473 HydrophobicContact CD1-CB 4.22Å; L457-L473 HydrophobicContact CD1-CD1 4.48Å; L457-L473 HydrophobicContact CD2-CD1 3.84Å; V469-L473 WeakPolarHBondContact O-CB 3.42Å; V469-L473 PolarHBondContact O-N 3.12Å; N470-L473 PolarHBondContact O-N 3.3Å; S471-L473 VanDerWaalsContact C-N 3.27Å; S471-L473 PolarHBondContact O-N 2.96Å; L473-V476 PolarHBondContact O-N 3.29Å; L473-R477 WeakPolarHBondContact O-CG 3.37Å; L473-R477 PolarHBondContact O-N 3.36Å; L473-L492 HydrophobicContact CD1-CD1 3.78Å; L473-E496 HydrophobicContact CD1-CG 3.96Å; L473-E496 HydrophobicContact CD2-CG 4.23Å; L473-Y499 HydrophobicContact CD2-CD1 4.06Å
474	E	94.3	Very high	91.6	Very high	78 Å²	78	62.1 Å²	62.1	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-74.4	-34.4	174	-165.6	62.8	-151.8	0	0	112.1	N470 S471 V476 R477 E478 R481	N470-E474 PolarHBondContact O-N 3.25Å; S471-E474 PolarHBondContact O-N 3.22Å; E474-V476 VanDerWaalsContact C-N 3.26Å; E474-V476 PolarHBondContact O-N 2.67Å; E474-R477 PolarHBondContact O-N 3.1Å; E474-R477 WeakPolarHBondContact OE2-CD 3.24Å; E474-R477 IonicContact OE2-CZ 3.26Å; E474-R477 IonicContact OE2-NE 3.94Å; E474-R477 IonicContact OE2-NH1 3.4Å; E474-R477 PolarHBondContact OE2-NH1 3.38Å; E474-E478 PolarHBondContact O-N 3.46Å; E474-R481 IonicContact OE1-CZ 3.56Å; E474-R481 IonicContact OE1-NH1 3.51Å; E474-R481 PolarHBondContact OE1-NH1 3.1Å; E474-R481 IonicContact OE1-NH2 3.19Å; E474-R481 PolarHBondContact OE1-NH2 3.44Å
475	E	93.4	Very high	91.7	Very high	60 Å²	60	60.8 Å²	60.8	28%	0.28	31%	0.31	S	S	.	.	H	α-helix	trans	-55.2	-42.9	167.7	-72.7	172.1	-123.3	0	0	111.2	K453 S471 K472 I479	K453-E475 WeakPolarHBondContact CE-OE2 3.35Å; K453-E475 IonicContact NZ-OE2 2.68Å; K453-E475 PolarHBondContact NZ-OE2 3.29Å; S471-E475 PolarHBondContact O-N 2.98Å; S471-E475 VanDerWaalsContact O-N 3.09Å; K472-E475 VanDerWaalsContact CD-OE1 3.31Å; K472-E475 WeakPolarHBondContact CD-OE1 3.26Å; K472-E475 VanDerWaalsContact CE-OE1 3.31Å; K472-E475 WeakPolarHBondContact CE-OE1 3.36Å; K472-E475 IonicContact NZ-OE1 3.89Å; K472-E475 PolarHBondContact NZ-OE1 2.82Å; K472-E475 IonicContact NZ-OE2 2.6Å; K472-E475 PolarHBondContact NZ-OE2 2.76Å; K472-E475 WeakPolarHBondContact O-CB 3.2Å; K472-E475 PolarHBondContact O-N 2.88Å; E475-I479 PolarHBondContact O-N 3.5Å
476	V	94.3	Very high	91.8	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.7	-41.9	178.2	170.7	0	0	0	0	112.2	M450 K453 M454 K472 L473 E474 E478 I479 D480 L492	M450-V476 HydrophobicContact CE-CG1 3.52Å; M450-V476 HydrophobicContact SD-CG1 3.8Å; K453-V476 HydrophobicContact CB-CG2 3.58Å; M454-V476 HydrophobicContact SD-CG1 3.84Å; M454-V476 HydrophobicContact SD-CG2 4.37Å; K472-V476 VanDerWaalsContact O-CG2 3.25Å; K472-V476 WeakPolarHBondContact O-CG2 3.43Å; K472-V476 PolarHBondContact O-N 3.39Å; L473-V476 PolarHBondContact O-N 3.29Å; E474-V476 VanDerWaalsContact C-N 3.26Å; E474-V476 PolarHBondContact O-N 2.67Å; V476-E478 VanDerWaalsContact C-N 3.29Å; V476-E478 PolarHBondContact O-N 3.47Å; V476-I479 PolarHBondContact O-N 3.43Å; V476-I479 VanDerWaalsContact O-N 3.12Å; V476-D480 PolarHBondContact O-N 2.78Å; V476-L492 HydrophobicContact CG1-CD1 3.6Å; V476-L492 HydrophobicContact CG1-CD2 4.15Å; V476-L492 HydrophobicContact CG1-CG 4.4Å
477	R	93.6	Very high	91.8	Very high	67 Å²	67	61.1 Å²	61.1	25%	0.253	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-32.4	175.3	-73	174.4	-169.6	142.7	2.2	113.2	L473 E474 I479 D480 R481 E496	L473-R477 WeakPolarHBondContact O-CG 3.37Å; L473-R477 PolarHBondContact O-N 3.36Å; E474-R477 PolarHBondContact O-N 3.1Å; E474-R477 WeakPolarHBondContact OE2-CD 3.24Å; E474-R477 IonicContact OE2-CZ 3.26Å; E474-R477 IonicContact OE2-NE 3.94Å; E474-R477 IonicContact OE2-NH1 3.4Å; E474-R477 PolarHBondContact OE2-NH1 3.38Å; R477-I479 VanDerWaalsContact C-N 3.3Å; R477-D480 WeakPolarHBondContact O-CB 3.44Å; R477-D480 PolarHBondContact O-N 2.88Å; R477-R481 WeakPolarHBondContact O-CG 3.31Å; R477-R481 PolarHBondContact O-N 3.33Å; R477-R481 VanDerWaalsContact O-N 3.16Å; R477-E496 IonicContact CZ-OE1 2.58Å; R477-E496 IonicContact NE-OE1 2.73Å; R477-E496 PolarHBondContact NE-OE1 2.99Å; R477-E496 IonicContact NH2-OE1 3.44Å; R477-E496 PolarHBondContact NH2-OE1 2.94Å
478	E	93.1	Very high	91.8	Very high	93 Å²	93	61.6 Å²	61.6	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-68.3	-31.5	174.7	-176	60.2	-163.8	0	0	112	E474 V476 R481	E474-E478 PolarHBondContact O-N 3.46Å; V476-E478 VanDerWaalsContact C-N 3.29Å; V476-E478 PolarHBondContact O-N 3.47Å; E478-R481 WeakPolarHBondContact OE2-CD 3.27Å; E478-R481 IonicContact OE2-CZ 3.42Å; E478-R481 IonicContact OE2-NE 2.75Å; E478-R481 IonicContact OE2-NH1 2.79Å; E478-R481 PolarHBondContact OE2-NH1 3.43Å
479	I	92.6	Very high	91.7	Very high	12 Å²	12	63.3 Å²	63.3	6%	0.062	30%	0.295	C	S	.	.	H	α-helix	trans	-72.1	-41.3	172.3	-59	170.2	0	0	0	110.4	A446 R449 M450 K453 E475 V476 R477 R481 M482 V484	A446-I479 HydrophobicContact CB-CG2 4.33Å; R449-I479 HydrophobicContact CB-CD1 4.04Å; M450-I479 HydrophobicContact CB-CG2 4Å; M450-I479 HydrophobicContact SD-CB 4.06Å; M450-I479 HydrophobicContact SD-CG2 3.93Å; K453-I479 HydrophobicContact CB-CD1 4.39Å; K453-I479 HydrophobicContact CG-CD1 3.85Å; E475-I479 PolarHBondContact O-N 3.5Å; V476-I479 PolarHBondContact O-N 3.43Å; V476-I479 VanDerWaalsContact O-N 3.12Å; R477-I479 VanDerWaalsContact C-N 3.3Å; I479-R481 VanDerWaalsContact C-N 3.31Å; I479-R481 PolarHBondContact O-N 3.15Å; I479-M482 VanDerWaalsContact O-CB 3.27Å; I479-M482 WeakPolarHBondContact O-CB 3.36Å; I479-M482 PolarHBondContact O-N 2.74Å; I479-V484 HydrophobicContact CG2-CG2 3.94Å; I479-V484 VanDerWaalsContact O-CG2 3.23Å; I479-V484 WeakPolarHBondContact O-CG2 3.35Å
480	D	91.6	Very high	91.7	Very high	48 Å²	48	63.8 Å²	63.8	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-54.3	-43.1	176.2	-178	37.5	0	0	0	112.9	V476 R477 M482 N483 R489 L492	V476-D480 PolarHBondContact O-N 2.78Å; R477-D480 WeakPolarHBondContact O-CB 3.44Å; R477-D480 PolarHBondContact O-N 2.88Å; D480-M482 PolarHBondContact O-N 2.92Å; D480-N483 PolarHBondContact O-N 2.86Å; D480-R489 WeakPolarHBondContact OD1-CD 3.41Å; D480-R489 WeakPolarHBondContact OD1-CG 3.41Å; D480-L492 HydrophobicContact CB-CD2 4.1Å
481	R	91.4	Very high	91.6	Very high	141 Å²	141	60.8 Å²	60.8	53%	0.532	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-17.9	174.5	-70	167.4	-166.9	146.7	10	114	E474 R477 E478 I479 N483	E474-R481 IonicContact OE1-CZ 3.56Å; E474-R481 IonicContact OE1-NH1 3.51Å; E474-R481 PolarHBondContact OE1-NH1 3.1Å; E474-R481 IonicContact OE1-NH2 3.19Å; E474-R481 PolarHBondContact OE1-NH2 3.44Å; R477-R481 WeakPolarHBondContact O-CG 3.31Å; R477-R481 PolarHBondContact O-N 3.33Å; R477-R481 VanDerWaalsContact O-N 3.16Å; E478-R481 WeakPolarHBondContact OE2-CD 3.27Å; E478-R481 IonicContact OE2-CZ 3.42Å; E478-R481 IonicContact OE2-NE 2.75Å; E478-R481 IonicContact OE2-NH1 2.79Å; E478-R481 PolarHBondContact OE2-NH1 3.43Å; I479-R481 VanDerWaalsContact C-N 3.31Å; I479-R481 PolarHBondContact O-N 3.15Å; R481-N483 PolarHBondContact O-N 3.1Å
482	M	89.5	Confident	91.6	Very high	93 Å²	93	57.9 Å²	57.9	46%	0.458	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	16.8	176.1	-51.2	-176.3	-178.5	0	0	113.3	R449 I479 D480	R449-M482 PolarHBondContact NH2-SD 3.32Å; R449-M482 VanDerWaalsContact NH2-SD 3.44Å; I479-M482 VanDerWaalsContact O-CB 3.27Å; I479-M482 WeakPolarHBondContact O-CB 3.36Å; I479-M482 PolarHBondContact O-N 2.74Å; D480-M482 PolarHBondContact O-N 2.92Å
483	N	84.4	Confident	91.6	Very high	150 Å²	150	60.7 Å²	60.7	80%	0.802	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	64.3	-176.3	-69.2	-45.1	0	0	0	113.1	D480 R481	D480-N483 PolarHBondContact O-N 2.86Å; R481-N483 PolarHBondContact O-N 3.1Å
484	V	86	Confident	91.6	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.024	27%	0.272	C	S	.	.			trans	-70	149.7	173.5	-169.8	0	0	0	0	110.7	M450 I479 R488 R489	M450-V484 HydrophobicContact CB-CG1 4.44Å; M450-V484 HydrophobicContact CG-CG1 4.23Å; M450-V484 HydrophobicContact SD-CG2 4.33Å; I479-V484 HydrophobicContact CG2-CG2 3.94Å; I479-V484 VanDerWaalsContact O-CG2 3.23Å; I479-V484 WeakPolarHBondContact O-CG2 3.35Å; V484-R488 HydrophobicContact CG1-CB 3.7Å; V484-R488 HydrophobicContact CG1-CG 4.31Å; V484-R489 HydrophobicContact CB-CG 4.46Å; V484-R489 WeakPolarHBondContact O-CD 3.43Å; V484-R489 PolarHBondContact O-NE 3.04Å
485	D	88.3	Confident	91.6	Very high	67 Å²	67	57 Å²	57	36%	0.358	26%	0.255	S	S	.	.			trans	-39.7	139.2	166.7	153.5	48.9	0	0	0	113.2	E487 R488 R489	D485-E487 VanDerWaalsContact C-N 3.32Å; D485-E487 PolarHBondContact O-N 3.01Å; D485-E487 PolarHBondContact OD1-N 3.02Å; D485-R488 PolarHBondContact O-N 3.46Å; D485-R488 IonicContact OD2-CZ 3.72Å; D485-R488 IonicContact OD2-NH1 2.63Å; D485-R488 PolarHBondContact OD2-NH1 3.23Å; D485-R489 PolarHBondContact O-N 3.38Å
486	W	90	Very high	91.6	Very high	131 Å²	131	55.2 Å²	55.2	50%	0.496	25%	0.246	S	C	.	.	H	α-helix	trans	-57.6	-39.7	-173.8	175	88.7	0	0	0	113	R488 R489 T490 T519	W486-R488 VanDerWaalsContact C-N 3.32Å; W486-R488 PolarHBondContact O-N 3.22Å; W486-R489 WeakPolarHBondContact O-CB 3.35Å; W486-R489 PolarHBondContact O-N 3Å; W486-R489 VanDerWaalsContact O-N 3.1Å; W486-T490 PolarHBondContact O-N 3.5Å; W486-T490 PolarHBondContact O-OG1 2.77Å; W486-T519 HydrophobicContact CH2-CG2 3.85Å; W486-T519 HydrophobicContact CZ2-CG2 4.1Å
487	E	90.7	Very high	91.6	Very high	49 Å²	49	55.2 Å²	55.2	23%	0.229	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-40.6	-179.2	170.9	163.4	-158.3	0	0	112.2	D485 R489 T490 R491 R521	D485-E487 VanDerWaalsContact C-N 3.32Å; D485-E487 PolarHBondContact O-N 3.01Å; D485-E487 PolarHBondContact OD1-N 3.02Å; E487-R489 VanDerWaalsContact C-N 3.28Å; E487-R489 PolarHBondContact O-N 3.31Å; E487-T490 WeakPolarHBondContact O-CB 3.26Å; E487-T490 PolarHBondContact O-N 3.25Å; E487-R491 PolarHBondContact O-N 3.43Å; E487-R491 IonicContact OE1-NH2 3.49Å; E487-R521 WeakPolarHBondContact OE1-CD 3.22Å; E487-R521 IonicContact OE1-CZ 2.73Å; E487-R521 IonicContact OE1-NE 3.41Å; E487-R521 IonicContact OE1-NH1 2.71Å; E487-R521 PolarHBondContact OE1-NH1 2.93Å; E487-R521 IonicContact OE2-NH1 3.45Å; E487-R521 PolarHBondContact OE2-NH1 3.45Å
488	R	91	Very high	91.5	Very high	55 Å²	55	53.6 Å²	53.6	21%	0.208	24%	0.24	C	C	.	.	H	α-helix	trans	-68.5	-28.1	177.4	-70.4	170.1	171.7	78.9	1.6	112.6	M450 D451 V484 D485 W486 R491 L492	M450-R488 HydrophobicContact CG-CB 4.25Å; D451-R488 IonicContact OD1-CZ 2.87Å; D451-R488 IonicContact OD1-NE 2.74Å; D451-R488 PolarHBondContact OD1-NE 3.3Å; D451-R488 IonicContact OD1-NH2 3.62Å; D451-R488 IonicContact OD2-CZ 2.87Å; D451-R488 IonicContact OD2-NE 3.71Å; D451-R488 PolarHBondContact OD2-NE 3.41Å; D451-R488 IonicContact OD2-NH2 3.78Å; D451-R488 PolarHBondContact OD2-NH2 3.38Å; V484-R488 HydrophobicContact CG1-CB 3.7Å; V484-R488 HydrophobicContact CG1-CG 4.31Å; D485-R488 PolarHBondContact O-N 3.46Å; D485-R488 IonicContact OD2-CZ 3.72Å; D485-R488 IonicContact OD2-NH1 2.63Å; D485-R488 PolarHBondContact OD2-NH1 3.23Å; W486-R488 VanDerWaalsContact C-N 3.32Å; W486-R488 PolarHBondContact O-N 3.22Å; R488-R491 PolarHBondContact O-N 3.02Å; R488-L492 PolarHBondContact O-N 3.28Å
489	R	91.4	Very high	91.6	Very high	103 Å²	103	50 Å²	50	39%	0.389	22%	0.223	S	C	.	.	H	α-helix	trans	-74.2	-39.5	173.3	-62.5	-170.5	-77.7	140.2	-3.1	111.8	D480 V484 D485 W486 E487 R491 L492 K493	D480-R489 WeakPolarHBondContact OD1-CD 3.41Å; D480-R489 WeakPolarHBondContact OD1-CG 3.41Å; V484-R489 HydrophobicContact CB-CG 4.46Å; V484-R489 WeakPolarHBondContact O-CD 3.43Å; V484-R489 PolarHBondContact O-NE 3.04Å; D485-R489 PolarHBondContact O-N 3.38Å; W486-R489 WeakPolarHBondContact O-CB 3.35Å; W486-R489 PolarHBondContact O-N 3Å; W486-R489 VanDerWaalsContact O-N 3.1Å; E487-R489 VanDerWaalsContact C-N 3.28Å; E487-R489 PolarHBondContact O-N 3.31Å; R489-R491 VanDerWaalsContact C-N 3.32Å; R489-L492 PolarHBondContact O-N 3.21Å; R489-K493 PolarHBondContact O-N 3.42Å
490	T	93.3	Very high	91.7	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-41	168.6	-58.2	0	0	0	0	111.1	W486 E487 K493 A494 L516	W486-T490 PolarHBondContact O-N 3.5Å; W486-T490 PolarHBondContact O-OG1 2.77Å; E487-T490 WeakPolarHBondContact O-CB 3.26Å; E487-T490 PolarHBondContact O-N 3.25Å; T490-K493 PolarHBondContact O-N 2.94Å; T490-A494 PolarHBondContact O-N 3.25Å; T490-L516 HydrophobicContact CG2-CD2 3.6Å; T490-L516 VanDerWaalsContact O-CD2 3.31Å; T490-L516 WeakPolarHBondContact O-CD2 3.46Å
491	R	92.4	Very high	91.7	Very high	23 Å²	23	48.9 Å²	48.9	9%	0.087	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-45.5	172.1	-161	177.8	-63.4	141.7	7.2	111.8	L320 D451 M454 E487 R488 R489 K493 A494 Y495 E524	L320-R491 VanDerWaalsContact CD1-CZ 3.49Å; D451-R491 IonicContact OD1-NH1 3.23Å; M454-R491 HydrophobicContact CE-CB 4.24Å; M454-R491 HydrophobicContact CE-CG 3.82Å; E487-R491 PolarHBondContact O-N 3.43Å; E487-R491 IonicContact OE1-NH2 3.49Å; R488-R491 PolarHBondContact O-N 3.02Å; R489-R491 VanDerWaalsContact C-N 3.32Å; R491-K493 VanDerWaalsContact C-N 3.35Å; R491-K493 PolarHBondContact O-N 3.07Å; R491-A494 WeakPolarHBondContact O-CB 3.43Å; R491-A494 PolarHBondContact O-N 2.94Å; R491-A494 VanDerWaalsContact O-N 3.09Å; R491-Y495 HydrophobicContact CG-CD2 4.41Å; R491-Y495 HydrophobicContact CG-CE2 3.93Å; R491-Y495 VanDerWaalsContact O-CD2 3.26Å; R491-Y495 WeakPolarHBondContact O-CD2 3.31Å; R491-Y495 PolarHBondContact O-N 3.47Å; R491-E524 WeakPolarHBondContact CD-OE1 3.32Å
492	L	94	Very high	91.7	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-56.2	-45.2	175.5	176.3	56.6	0	0	0	112.4	M450 M454 L473 V476 D480 R488 R489 A494 Y495 E496	M450-L492 HydrophobicContact CE-CB 4.04Å; M450-L492 HydrophobicContact CE-CD2 4.09Å; M454-L492 HydrophobicContact SD-CD1 4.4Å; L473-L492 HydrophobicContact CD1-CD1 3.78Å; V476-L492 HydrophobicContact CG1-CD1 3.6Å; V476-L492 HydrophobicContact CG1-CD2 4.15Å; V476-L492 HydrophobicContact CG1-CG 4.4Å; D480-L492 HydrophobicContact CB-CD2 4.1Å; R488-L492 PolarHBondContact O-N 3.28Å; R489-L492 PolarHBondContact O-N 3.21Å; L492-A494 PolarHBondContact O-N 3.06Å; L492-Y495 PolarHBondContact O-N 3.5Å; L492-Y495 VanDerWaalsContact O-N 3.11Å; L492-E496 HydrophobicContact CD1-CG 4.1Å; L492-E496 HydrophobicContact CG-CG 4.39Å; L492-E496 PolarHBondContact O-N 3.17Å
493	K	94	Very high	91.8	Very high	81 Å²	81	43 Å²	43	35%	0.352	20%	0.2	S	C	.	.	H	α-helix	trans	-53.9	-38.4	175.8	-77.6	-172	177.3	-172.2	0	112.7	R489 T490 R491 E496 G497 D515 L516	R489-K493 PolarHBondContact O-N 3.42Å; T490-K493 PolarHBondContact O-N 2.94Å; R491-K493 VanDerWaalsContact C-N 3.35Å; R491-K493 PolarHBondContact O-N 3.07Å; K493-E496 PolarHBondContact O-N 3.11Å; K493-G497 PolarHBondContact O-N 3.33Å; K493-D515 IonicContact NZ-OD2 3.89Å; K493-D515 PolarHBondContact NZ-OD2 3.5Å; K493-L516 HydrophobicContact CB-CD1 4.2Å; K493-L516 HydrophobicContact CB-CD2 4.1Å; K493-L516 HydrophobicContact CB-CG 4.36Å
494	A	93.8	Very high	92.2	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-66.1	-39.6	179.9	0	0	0	0	0	112.3	T490 R491 L492 Y498 L516 F520 S522	T490-A494 PolarHBondContact O-N 3.25Å; R491-A494 WeakPolarHBondContact O-CB 3.43Å; R491-A494 PolarHBondContact O-N 2.94Å; R491-A494 VanDerWaalsContact O-N 3.09Å; L492-A494 PolarHBondContact O-N 3.06Å; A494-Y498 WeakPolarHBondContact O-CB 3.29Å; A494-Y498 PolarHBondContact O-N 2.76Å; A494-L516 HydrophobicContact CB-CD1 3.71Å; A494-F520 HydrophobicContact CB-CE2 4.31Å; A494-S522 WeakPolarHBondContact CB-OG 3.48Å
495	Y	94.1	Very high	92.5	Very high	1 Å²	1	48.4 Å²	48.4	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-71.8	-38.5	176.8	-75.8	-116.6	0	0	0	111.3	M454 L457 R458 M461 R491 L492 Y499 E524 L525	M454-Y495 HydrophobicContact CE-CD1 4.15Å; M454-Y495 HydrophobicContact CE-CD2 3.42Å; M454-Y495 VanDerWaalsContact CE-CD2 3.42Å; M454-Y495 HydrophobicContact CE-CE1 4.26Å; M454-Y495 HydrophobicContact CE-CE2 3.57Å; M454-Y495 HydrophobicContact CE-CG 3.71Å; L457-Y495 HydrophobicContact CB-CD1 4.46Å; L457-Y495 HydrophobicContact CD2-CD1 3.6Å; L457-Y495 HydrophobicContact CD2-CE1 4.45Å; L457-Y495 HydrophobicContact CD2-CG 4.11Å; L457-Y495 HydrophobicContact CG-CD1 3.92Å; R458-Y495 VanDerWaalsContact CD-OH 3.29Å; R458-Y495 WeakPolarHBondContact CD-OH 3.2Å; R458-Y495 HydrophobicContact CG-CE1 3.52Å; R458-Y495 WeakPolarHBondContact CG-OH 3.38Å; M461-Y495 HydrophobicContact CE-CD1 3.88Å; M461-Y495 HydrophobicContact CE-CG 4.36Å; M461-Y495 WeakPolarHBondContact CE-O 3.39Å; M461-Y495 HydrophobicContact SD-CD1 3.89Å; M461-Y495 HydrophobicContact SD-CE1 4.5Å; R491-Y495 HydrophobicContact CG-CD2 4.41Å; R491-Y495 HydrophobicContact CG-CE2 3.93Å; R491-Y495 VanDerWaalsContact O-CD2 3.26Å; R491-Y495 WeakPolarHBondContact O-CD2 3.31Å; R491-Y495 PolarHBondContact O-N 3.47Å; L492-Y495 PolarHBondContact O-N 3.5Å; L492-Y495 VanDerWaalsContact O-N 3.11Å; Y495-Y499 VanDerWaalsContact O-CB 3.24Å; Y495-Y499 WeakPolarHBondContact O-CB 3.28Å; Y495-Y499 PolarHBondContact O-N 3.05Å; Y495-E524 VanDerWaalsContact CE2-OE1 3.29Å; Y495-E524 WeakPolarHBondContact CE2-OE1 3.47Å; Y495-E524 VanDerWaalsContact OH-CG 3.31Å; Y495-E524 WeakPolarHBondContact OH-CG 3.45Å; Y495-E524 PolarHBondContact OH-OE1 3.49Å; Y495-L525 HydrophobicContact CD1-CD2 4.46Å; Y495-L525 HydrophobicContact CD2-CD2 3.9Å; Y495-L525 HydrophobicContact CE2-CB 4.41Å; Y495-L525 HydrophobicContact CE2-CD2 4.13Å; Y495-L525 HydrophobicContact CG-CD2 4.1Å
496	E	93.7	Very high	92.8	Very high	22 Å²	22	48.8 Å²	48.8	10%	0.103	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-44.3	173.1	-73.1	-143.9	94	0	0	112.7	L473 R477 L492 K493 Y499 A500 K508 M512	L473-E496 HydrophobicContact CD1-CG 3.96Å; L473-E496 HydrophobicContact CD2-CG 4.23Å; R477-E496 IonicContact CZ-OE1 2.58Å; R477-E496 IonicContact NE-OE1 2.73Å; R477-E496 PolarHBondContact NE-OE1 2.99Å; R477-E496 IonicContact NH2-OE1 3.44Å; R477-E496 PolarHBondContact NH2-OE1 2.94Å; L492-E496 HydrophobicContact CD1-CG 4.1Å; L492-E496 HydrophobicContact CG-CG 4.39Å; L492-E496 PolarHBondContact O-N 3.17Å; K493-E496 PolarHBondContact O-N 3.11Å; E496-Y499 PolarHBondContact O-N 3.48Å; E496-A500 VanDerWaalsContact O-CB 3.29Å; E496-A500 WeakPolarHBondContact O-CB 3.29Å; E496-A500 PolarHBondContact O-N 3.01Å; E496-K508 IonicContact OE1-NZ 3.59Å; E496-K508 PolarHBondContact OE1-NZ 3.16Å; E496-K508 IonicContact OE2-NZ 2.69Å; E496-M512 HydrophobicContact CB-CE 4.07Å; E496-M512 HydrophobicContact CB-SD 3.48Å; E496-M512 WeakPolarHBondContact CB-SD 3.34Å; E496-M512 VanDerWaalsContact OE2-CE 3.3Å; E496-M512 WeakPolarHBondContact OE2-CE 3.42Å
497	G	93.8	Very high	92.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-43.7	177.5	0	0	0	0	0	112.5	K493 A500 M501	K493-G497 PolarHBondContact O-N 3.33Å; G497-A500 PolarHBondContact O-N 3.21Å; G497-M501 PolarHBondContact O-N 2.99Å
498	Y	93.1	Very high	93	Very high	33 Å²	33	48.9 Å²	48.9	13%	0.129	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-42.8	173.7	-175.1	-111.8	0	0	0	112.1	M461 A494 M501 L502 L525 M526 Y534	M461-Y498 HydrophobicContact SD-CD1 3.92Å; M461-Y498 HydrophobicContact SD-CE1 4.38Å; A494-Y498 WeakPolarHBondContact O-CB 3.29Å; A494-Y498 PolarHBondContact O-N 2.76Å; Y498-M501 HydrophobicContact CD2-CE 3.8Å; Y498-M501 PolarHBondContact O-N 3.44Å; Y498-L502 HydrophobicContact CD1-CD1 4.06Å; Y498-L502 HydrophobicContact CE1-CD1 3.74Å; Y498-L502 HydrophobicContact CE1-CG 4.41Å; Y498-L502 PolarHBondContact O-N 3.34Å; Y498-L502 VanDerWaalsContact O-N 3.17Å; Y498-L525 HydrophobicContact CD1-CD1 3.89Å; Y498-L525 HydrophobicContact CD1-CD2 4.3Å; Y498-L525 HydrophobicContact CD1-CG 4.42Å; Y498-L525 HydrophobicContact CE1-CD1 4.08Å; Y498-L525 HydrophobicContact CG-CD1 4.44Å; Y498-L525 HydrophobicContact CG-CD2 4.19Å; Y498-M526 HydrophobicContact CD2-CE 3.43Å; Y498-M526 VanDerWaalsContact CD2-CE 3.43Å; Y498-M526 HydrophobicContact CE2-CE 4.14Å; Y498-M526 HydrophobicContact CG-CE 3.87Å; Y498-Y534 HydrophobicContact CE2-CE2 4.4Å
499	Y	94.5	Very high	93.2	Very high	18 Å²	18	46.2 Å²	46.2	7%	0.071	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-38.1	176.8	-174.7	-117.2	0	0	0	113	K466 V469 N470 L473 Y495 E496 M501 L502 T503	K466-Y499 HydrophobicContact CG-CE2 4.37Å; K466-Y499 PolarHBondContact O-OH 3.28Å; V469-Y499 HydrophobicContact CB-CD2 4.28Å; V469-Y499 HydrophobicContact CB-CE2 3.91Å; V469-Y499 HydrophobicContact CG1-CD1 4.38Å; V469-Y499 HydrophobicContact CG1-CD2 3.43Å; V469-Y499 VanDerWaalsContact CG1-CD2 3.43Å; V469-Y499 HydrophobicContact CG1-CE1 4.45Å; V469-Y499 HydrophobicContact CG1-CE2 3.52Å; V469-Y499 HydrophobicContact CG1-CG 3.89Å; N470-Y499 PolarHBondContact ND2-OH 3.41Å; N470-Y499 WeakPolarHBondContact OD1-CE1 3.43Å; N470-Y499 VanDerWaalsContact OD1-CZ 3.29Å; N470-Y499 PolarHBondContact OD1-OH 3.49Å; L473-Y499 HydrophobicContact CD2-CD1 4.06Å; Y495-Y499 VanDerWaalsContact O-CB 3.24Å; Y495-Y499 WeakPolarHBondContact O-CB 3.28Å; Y495-Y499 PolarHBondContact O-N 3.05Å; E496-Y499 PolarHBondContact O-N 3.48Å; Y499-M501 VanDerWaalsContact C-N 3.29Å; Y499-M501 PolarHBondContact O-N 3.09Å; Y499-L502 HydrophobicContact CD2-CB 4.36Å; Y499-L502 HydrophobicContact CD2-CD1 4.42Å; Y499-L502 CarbonylContact O-C 3.53Å; Y499-L502 WeakPolarHBondContact O-CA 3.39Å; Y499-L502 WeakPolarHBondContact O-CB 3.37Å; Y499-L502 PolarHBondContact O-N 3.33Å; Y499-T503 HydrophobicContact CD1-CG2 4.4Å; Y499-T503 HydrophobicContact CE1-CG2 3.8Å; Y499-T503 HydrophobicContact CE2-CG2 3.99Å; Y499-T503 PolarHBondContact O-N 3.47Å; Y499-T503 PolarHBondContact O-OG1 3.3Å
500	A	93.9	Very high	93.3	Very high	3 Å²	3	41.5 Å²	41.5	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-57.8	-42.3	175.8	0	0	0	0	0	111.3	E496 G497 T503 R504 D505 K508 A509	E496-A500 VanDerWaalsContact O-CB 3.29Å; E496-A500 WeakPolarHBondContact O-CB 3.29Å; E496-A500 PolarHBondContact O-N 3.01Å; G497-A500 PolarHBondContact O-N 3.21Å; A500-T503 WeakPolarHBondContact CA-OG1 3.41Å; A500-T503 CarbonylContact O-C 3.54Å; A500-T503 PolarHBondContact O-N 3.08Å; A500-T503 VanDerWaalsContact O-N 3.16Å; A500-T503 PolarHBondContact O-OG1 3Å; A500-R504 PolarHBondContact O-N 3.46Å; A500-D505 HydrophobicContact CB-CB 4.29Å; A500-D505 PolarHBondContact O-N 3.46Å; A500-K508 HydrophobicContact CB-CB 4.21Å; A500-K508 HydrophobicContact CB-CD 4.38Å; A500-K508 HydrophobicContact CB-CG 4.27Å; A500-A509 HydrophobicContact CB-CB 3.88Å
501	M	92	Very high	93.3	Very high	32 Å²	32	44.8 Å²	44.8	16%	0.158	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-44.5	170.8	-64.8	-169	-68.8	0	0	112.7	G497 Y498 Y499 T503 R504 A509 L513 Y534	G497-M501 PolarHBondContact O-N 2.99Å; Y498-M501 HydrophobicContact CD2-CE 3.8Å; Y498-M501 PolarHBondContact O-N 3.44Å; Y499-M501 VanDerWaalsContact C-N 3.29Å; Y499-M501 PolarHBondContact O-N 3.09Å; M501-T503 PolarHBondContact O-N 3.18Å; M501-R504 PolarHBondContact O-N 3.43Å; M501-A509 HydrophobicContact CG-CB 3.58Å; M501-L513 HydrophobicContact CE-CD1 3.88Å; M501-L513 HydrophobicContact CG-CD1 4.34Å; M501-L513 HydrophobicContact SD-CD1 3.79Å; M501-Y534 HydrophobicContact CE-CD2 3.76Å; M501-Y534 HydrophobicContact CE-CG 3.89Å; M501-Y534 HydrophobicContact SD-CG 4.25Å
502	L	91.2	Very high	93.4	Very high	53 Å²	53	45.2 Å²	45.2	28%	0.277	21%	0.211	S	C	.	.	H	α-helix	trans	-61.4	-27.6	175.6	-66.9	174.2	0	0	0	112.5	M464 K466 Y498 Y499	M464-L502 HydrophobicContact SD-CD2 4.47Å; K466-L502 VanDerWaalsContact CE-O 3.3Å; K466-L502 WeakPolarHBondContact CE-O 3.43Å; K466-L502 PolarHBondContact NZ-O 3.02Å; Y498-L502 HydrophobicContact CD1-CD1 4.06Å; Y498-L502 HydrophobicContact CE1-CD1 3.74Å; Y498-L502 HydrophobicContact CE1-CG 4.41Å; Y498-L502 PolarHBondContact O-N 3.34Å; Y498-L502 VanDerWaalsContact O-N 3.17Å; Y499-L502 HydrophobicContact CD2-CB 4.36Å; Y499-L502 HydrophobicContact CD2-CD1 4.42Å; Y499-L502 CarbonylContact O-C 3.53Å; Y499-L502 WeakPolarHBondContact O-CA 3.39Å; Y499-L502 WeakPolarHBondContact O-CB 3.37Å; Y499-L502 PolarHBondContact O-N 3.33Å
503	T	91.9	Very high	93.4	Very high	59 Å²	59	45 Å²	45	36%	0.362	21%	0.21	S	C	.	.	H	α-helix	trans	-88.1	-3.8	172.1	51.4	0	0	0	0	114.9	Y499 A500 M501 D505	Y499-T503 HydrophobicContact CD1-CG2 4.4Å; Y499-T503 HydrophobicContact CE1-CG2 3.8Å; Y499-T503 HydrophobicContact CE2-CG2 3.99Å; Y499-T503 PolarHBondContact O-N 3.47Å; Y499-T503 PolarHBondContact O-OG1 3.3Å; A500-T503 WeakPolarHBondContact CA-OG1 3.41Å; A500-T503 CarbonylContact O-C 3.54Å; A500-T503 PolarHBondContact O-N 3.08Å; A500-T503 VanDerWaalsContact O-N 3.16Å; A500-T503 PolarHBondContact O-OG1 3Å; M501-T503 PolarHBondContact O-N 3.18Å; T503-D505 VanDerWaalsContact C-N 3.31Å
504	R	92.5	Very high	93.3	Very high	202 Å²	202	45 Å²	45	76%	0.762	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	25.2	-173.4	-51.9	176.7	177.3	169	-2.4	114.8	A500 M501 Y506	A500-R504 PolarHBondContact O-N 3.46Å; M501-R504 PolarHBondContact O-N 3.43Å; R504-Y506 HydrophobicContact CB-CE2 4.12Å; R504-Y506 PolarHBondContact O-N 3.25Å
505	D	93	Very high	93.3	Very high	65 Å²	65	49 Å²	49	35%	0.348	24%	0.235	S	C	.	.			trans	-90.7	83.6	171.3	-179.4	-5.1	0	0	0	108.6	A500 T503 K508 A509	A500-D505 HydrophobicContact CB-CB 4.29Å; A500-D505 PolarHBondContact O-N 3.46Å; T503-D505 VanDerWaalsContact C-N 3.31Å; D505-K508 VanDerWaalsContact CG-CB 3.41Å; D505-K508 VanDerWaalsContact OD1-CB 3.27Å; D505-K508 WeakPolarHBondContact OD1-CB 3.35Å; D505-K508 PolarHBondContact OD1-N 3.32Å; D505-K508 VanDerWaalsContact OD2-CB 3.26Å; D505-K508 WeakPolarHBondContact OD2-CB 3.46Å; D505-A509 VanDerWaalsContact O-CB 3.25Å; D505-A509 WeakPolarHBondContact O-CB 3.22Å; D505-A509 PolarHBondContact O-N 3.24Å; D505-A509 VanDerWaalsContact O-N 3.11Å
506	Y	94.1	Very high	93.2	Very high	75 Å²	75	49 Å²	49	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-78.2	-21.7	-174.9	-61.3	-68.6	0	0	0	113.6	R504 S510 I541	R504-Y506 HydrophobicContact CB-CE2 4.12Å; R504-Y506 PolarHBondContact O-N 3.25Å; Y506-S510 WeakPolarHBondContact O-CB 3.35Å; Y506-S510 PolarHBondContact O-N 3.27Å; Y506-S510 PolarHBondContact O-OG 2.91Å; Y506-I541 HydrophobicContact CD1-CG2 4.48Å; Y506-I541 HydrophobicContact CD2-CB 4.36Å; Y506-I541 HydrophobicContact CD2-CG2 3.46Å; Y506-I541 VanDerWaalsContact CD2-CG2 3.46Å; Y506-I541 HydrophobicContact CE1-CD1 4.26Å; Y506-I541 HydrophobicContact CE2-CG2 3.88Å; Y506-I541 HydrophobicContact CG-CB 4.21Å; Y506-I541 HydrophobicContact CG-CG2 3.78Å
507	E	92.7	Very high	93.1	Very high	116 Å²	116	50.9 Å²	50.9	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-72.5	-45.2	177	-175.1	-177.8	-177.5	0	0	111	S510 T511	E507-S510 PolarHBondContact O-OG 3.46Å; E507-S510 VanDerWaalsContact O-OG 3.13Å; E507-T511 PolarHBondContact O-N 3.11Å; E507-T511 PolarHBondContact O-OG1 3.04Å
508	K	93.3	Very high	92.9	Very high	65 Å²	65	56.5 Å²	56.5	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-66.2	-41.6	170.1	-173.6	176.9	175.4	-178.6	0	111.3	E496 A500 D505 M512	E496-K508 IonicContact OE1-NZ 3.59Å; E496-K508 PolarHBondContact OE1-NZ 3.16Å; E496-K508 IonicContact OE2-NZ 2.69Å; A500-K508 HydrophobicContact CB-CB 4.21Å; A500-K508 HydrophobicContact CB-CD 4.38Å; A500-K508 HydrophobicContact CB-CG 4.27Å; D505-K508 VanDerWaalsContact CG-CB 3.41Å; D505-K508 VanDerWaalsContact OD1-CB 3.27Å; D505-K508 WeakPolarHBondContact OD1-CB 3.35Å; D505-K508 PolarHBondContact OD1-N 3.32Å; D505-K508 VanDerWaalsContact OD2-CB 3.26Å; D505-K508 WeakPolarHBondContact OD2-CB 3.46Å; K508-M512 HydrophobicContact CD-CE 4.49Å; K508-M512 HydrophobicContact CD-SD 4.25Å; K508-M512 WeakPolarHBondContact CE-SD 3.18Å; K508-M512 HydrophobicContact CG-CE 4.34Å; K508-M512 HydrophobicContact CG-CG 4.46Å; K508-M512 HydrophobicContact CG-SD 3.81Å; K508-M512 WeakPolarHBondContact O-CB 3.35Å; K508-M512 WeakPolarHBondContact O-CG 3.49Å; K508-M512 PolarHBondContact O-N 3.37Å; K508-M512 VanDerWaalsContact O-N 3.08Å
509	A	94.6	Very high	92.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-45.2	-179.2	0	0	0	0	0	113	A500 M501 D505 M512 L513 A538	A500-A509 HydrophobicContact CB-CB 3.88Å; M501-A509 HydrophobicContact CG-CB 3.58Å; D505-A509 VanDerWaalsContact O-CB 3.25Å; D505-A509 WeakPolarHBondContact O-CB 3.22Å; D505-A509 PolarHBondContact O-N 3.24Å; D505-A509 VanDerWaalsContact O-N 3.11Å; A509-M512 PolarHBondContact O-N 3.47Å; A509-L513 HydrophobicContact CB-CD1 4.39Å; A509-L513 VanDerWaalsContact O-CB 3.27Å; A509-L513 WeakPolarHBondContact O-CB 3.39Å; A509-L513 WeakPolarHBondContact O-CG 3.46Å; A509-L513 PolarHBondContact O-N 3.24Å; A509-A538 HydrophobicContact CB-CB 4.08Å
510	S	93.8	Very high	92.6	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-50.4	-179.8	62.7	0	0	0	0	110.8	Y506 E507 M512 L513 L514	Y506-S510 WeakPolarHBondContact O-CB 3.35Å; Y506-S510 PolarHBondContact O-N 3.27Å; Y506-S510 PolarHBondContact O-OG 2.91Å; E507-S510 PolarHBondContact O-OG 3.46Å; E507-S510 VanDerWaalsContact O-OG 3.13Å; S510-M512 PolarHBondContact O-N 2.94Å; S510-L513 PolarHBondContact O-N 2.98Å; S510-L514 WeakPolarHBondContact O-CB 3.48Å; S510-L514 VanDerWaalsContact O-CG 3.23Å; S510-L514 WeakPolarHBondContact O-CG 3.38Å; S510-L514 PolarHBondContact O-N 3.24Å
511	T	93.5	Very high	92.3	Very high	83 Å²	83	62.9 Å²	62.9	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-55.5	-49.7	177.9	-52.1	0	0	0	0	111.5	E507 D515	E507-T511 PolarHBondContact O-N 3.11Å; E507-T511 PolarHBondContact O-OG1 3.04Å; T511-D515 PolarHBondContact O-N 3.37Å
512	M	93.6	Very high	92.1	Very high	32 Å²	32	61.4 Å²	61.4	16%	0.158	31%	0.307	C	S	.	.	H	α-helix	trans	-71.5	-32.6	-177.9	-72.6	-176.8	157.4	0	0	114.1	E496 K508 A509 S510 L516	E496-M512 HydrophobicContact CB-CE 4.07Å; E496-M512 HydrophobicContact CB-SD 3.48Å; E496-M512 WeakPolarHBondContact CB-SD 3.34Å; E496-M512 VanDerWaalsContact OE2-CE 3.3Å; E496-M512 WeakPolarHBondContact OE2-CE 3.42Å; K508-M512 HydrophobicContact CD-CE 4.49Å; K508-M512 HydrophobicContact CD-SD 4.25Å; K508-M512 WeakPolarHBondContact CE-SD 3.18Å; K508-M512 HydrophobicContact CG-CE 4.34Å; K508-M512 HydrophobicContact CG-CG 4.46Å; K508-M512 HydrophobicContact CG-SD 3.81Å; K508-M512 WeakPolarHBondContact O-CB 3.35Å; K508-M512 WeakPolarHBondContact O-CG 3.49Å; K508-M512 PolarHBondContact O-N 3.37Å; K508-M512 VanDerWaalsContact O-N 3.08Å; A509-M512 PolarHBondContact O-N 3.47Å; S510-M512 PolarHBondContact O-N 2.94Å; M512-L516 WeakPolarHBondContact O-CD1 3.43Å; M512-L516 VanDerWaalsContact O-CG 3.26Å; M512-L516 WeakPolarHBondContact O-CG 3.49Å
513	L	93.5	Very high	92	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-81.4	-33.9	179.9	-66.2	170.1	0	0	0	112.2	M501 A509 S510 L516 T517 M531 A535 A538	M501-L513 HydrophobicContact CE-CD1 3.88Å; M501-L513 HydrophobicContact CG-CD1 4.34Å; M501-L513 HydrophobicContact SD-CD1 3.79Å; A509-L513 HydrophobicContact CB-CD1 4.39Å; A509-L513 VanDerWaalsContact O-CB 3.27Å; A509-L513 WeakPolarHBondContact O-CB 3.39Å; A509-L513 WeakPolarHBondContact O-CG 3.46Å; A509-L513 PolarHBondContact O-N 3.24Å; S510-L513 PolarHBondContact O-N 2.98Å; L513-L516 HydrophobicContact CD2-CD1 4.42Å; L513-L516 PolarHBondContact O-N 3.09Å; L513-T517 PolarHBondContact O-N 3.12Å; L513-M531 HydrophobicContact CD2-CG 4.38Å; L513-A535 HydrophobicContact CB-CB 3.77Å; L513-A538 HydrophobicContact CD1-CB 4.3Å
514	L	93.3	Very high	91.9	Very high	82 Å²	82	63 Å²	63	43%	0.429	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-44.8	174	-73.2	172.7	0	0	0	111.6	S510 L516 T517 S539	S510-L514 WeakPolarHBondContact O-CB 3.48Å; S510-L514 VanDerWaalsContact O-CG 3.23Å; S510-L514 WeakPolarHBondContact O-CG 3.38Å; S510-L514 PolarHBondContact O-N 3.24Å; L514-L516 PolarHBondContact O-N 2.81Å; L514-L516 VanDerWaalsContact O-N 3.1Å; L514-T517 WeakPolarHBondContact O-CB 3.28Å; L514-T517 WeakPolarHBondContact O-CG2 3.35Å; L514-T517 PolarHBondContact O-N 3.27Å; L514-T517 VanDerWaalsContact O-N 3.14Å; L514-T517 PolarHBondContact O-OG1 2.87Å; L514-S539 WeakPolarHBondContact CD1-OG 3.49Å
515	D	92.9	Very high	91.6	Very high	84 Å²	84	53.7 Å²	53.7	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-50.7	-33.2	172.6	-90.3	4	0	0	0	113.5	K493 T511	K493-D515 IonicContact NZ-OD2 3.89Å; K493-D515 PolarHBondContact NZ-OD2 3.5Å; T511-D515 PolarHBondContact O-N 3.37Å
516	L	93.5	Very high	91.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-86.3	-16.5	-174.1	-68.1	165.6	0	0	0	113.8	T490 K493 A494 M512 L513 L514 C518 T519 F520 M531	T490-L516 HydrophobicContact CG2-CD2 3.6Å; T490-L516 VanDerWaalsContact O-CD2 3.31Å; T490-L516 WeakPolarHBondContact O-CD2 3.46Å; K493-L516 HydrophobicContact CB-CD1 4.2Å; K493-L516 HydrophobicContact CB-CD2 4.1Å; K493-L516 HydrophobicContact CB-CG 4.36Å; A494-L516 HydrophobicContact CB-CD1 3.71Å; M512-L516 WeakPolarHBondContact O-CD1 3.43Å; M512-L516 VanDerWaalsContact O-CG 3.26Å; M512-L516 WeakPolarHBondContact O-CG 3.49Å; L513-L516 HydrophobicContact CD2-CD1 4.42Å; L513-L516 PolarHBondContact O-N 3.09Å; L514-L516 PolarHBondContact O-N 2.81Å; L514-L516 VanDerWaalsContact O-N 3.1Å; L516-C518 PolarHBondContact O-N 3.44Å; L516-C518 VanDerWaalsContact O-N 3.1Å; L516-T519 PolarHBondContact O-N 2.86Å; L516-F520 WeakPolarHBondContact O-CB 3.46Å; L516-F520 PolarHBondContact O-N 2.75Å; L516-M531 HydrophobicContact CB-CE 4.46Å; L516-M531 HydrophobicContact CB-SD 4.24Å
517	T	91	Very high	91.3	Very high	62 Å²	62	50.5 Å²	50.5	38%	0.38	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-37.8	-176.6	54.7	0	0	0	0	113.3	L513 L514 A535	L513-T517 PolarHBondContact O-N 3.12Å; L514-T517 WeakPolarHBondContact O-CB 3.28Å; L514-T517 WeakPolarHBondContact O-CG2 3.35Å; L514-T517 PolarHBondContact O-N 3.27Å; L514-T517 VanDerWaalsContact O-N 3.14Å; L514-T517 PolarHBondContact O-OG1 2.87Å; T517-A535 HydrophobicContact CG2-CB 4.5Å
518	C	89.6	Confident	91.2	Very high	118 Å²	118	48.6 Å²	48.6	80%	0.797	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-11.9	179.4	-61.7	0	0	0	0	115	L516	L516-C518 PolarHBondContact O-N 3.44Å; L516-C518 VanDerWaalsContact O-N 3.1Å
519	T	91.6	Very high	91.3	Very high	46 Å²	46	53.1 Å²	53.1	28%	0.282	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	11.9	-165.1	60.1	0	0	0	0	114.9	W486 L516 R521	W486-T519 HydrophobicContact CH2-CG2 3.85Å; W486-T519 HydrophobicContact CZ2-CG2 4.1Å; L516-T519 PolarHBondContact O-N 2.86Å; T519-R521 PolarHBondContact O-N 3.24Å
520	F	90.2	Very high	91.2	Very high	12 Å²	12	55.3 Å²	55.3	5%	0.053	29%	0.287	C	S	.	.			trans	-62.2	126.7	-174.9	-174.2	-99.1	0	0	0	113.7	A494 L516 S522 Y523 M526 L528 M531	A494-F520 HydrophobicContact CB-CE2 4.31Å; L516-F520 WeakPolarHBondContact O-CB 3.46Å; L516-F520 PolarHBondContact O-N 2.75Å; F520-S522 VanDerWaalsContact CZ-C 3.5Å; F520-S522 VanDerWaalsContact CZ-O 3.27Å; F520-S522 WeakPolarHBondContact CZ-O 3.44Å; F520-Y523 HydrophobicContact CD1-CD1 4.41Å; F520-Y523 HydrophobicContact CD1-CE1 4.05Å; F520-Y523 AromaticContact CE1-CD1 3.97Å; F520-Y523 HydrophobicContact CE1-CD1 3.97Å; F520-Y523 HydrophobicContact CE1-CE1 4.05Å; F520-Y523 HydrophobicContact CE1-CG 4.43Å; F520-M526 WeakPolarHBondContact CE1-O 3.34Å; F520-M526 HydrophobicContact CE2-CG 4.3Å; F520-M526 HydrophobicContact CZ-CG 3.78Å; F520-M526 WeakPolarHBondContact CZ-O 3.46Å; F520-L528 HydrophobicContact CB-CD1 4Å; F520-L528 HydrophobicContact CD1-CB 4.48Å; F520-L528 HydrophobicContact CD1-CD1 4.1Å; F520-L528 HydrophobicContact CG-CD1 4.29Å; F520-M531 HydrophobicContact CB-CE 3.66Å; F520-M531 HydrophobicContact CD2-CB 4.3Å; F520-M531 HydrophobicContact CD2-CE 3.96Å; F520-M531 HydrophobicContact CD2-CG 3.71Å; F520-M531 HydrophobicContact CD2-SD 4.44Å; F520-M531 HydrophobicContact CE2-CB 4.1Å; F520-M531 HydrophobicContact CE2-CG 3.73Å; F520-M531 HydrophobicContact CG-CE 3.86Å; F520-M531 HydrophobicContact CG-CG 4.38Å; F520-M531 HydrophobicContact CZ-CB 4.3Å; F520-M531 HydrophobicContact CZ-CG 4.43Å
521	R	87.2	Confident	91.1	Very high	129 Å²	129	55.1 Å²	55.1	49%	0.487	29%	0.286	S	S	.	.			trans	-134.9	14.2	174.8	-62.7	-173.4	179.2	-168.2	0.4	113.9	E487 T519 Y523	E487-R521 WeakPolarHBondContact OE1-CD 3.22Å; E487-R521 IonicContact OE1-CZ 2.73Å; E487-R521 IonicContact OE1-NE 3.41Å; E487-R521 IonicContact OE1-NH1 2.71Å; E487-R521 PolarHBondContact OE1-NH1 2.93Å; E487-R521 IonicContact OE2-NH1 3.45Å; E487-R521 PolarHBondContact OE2-NH1 3.45Å; T519-R521 PolarHBondContact O-N 3.24Å; R521-Y523 VanDerWaalsContact C-N 3.33Å; R521-Y523 PolarHBondContact O-N 3.1Å
522	S	88.1	Confident	91.2	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.007	28%	0.28	C	S	.	.			trans	-96.2	49.7	-172.3	-47.5	0	0	0	0	112.4	A494 F520 E524 L525 M526	A494-S522 WeakPolarHBondContact CB-OG 3.48Å; F520-S522 VanDerWaalsContact CZ-C 3.5Å; F520-S522 VanDerWaalsContact CZ-O 3.27Å; F520-S522 WeakPolarHBondContact CZ-O 3.44Å; S522-E524 WeakPolarHBondContact CA-OE2 3.4Å; S522-E524 PolarHBondContact O-N 3.31Å; S522-L525 PolarHBondContact O-N 3.1Å; S522-M526 PolarHBondContact O-N 3.03Å
523	Y	89.5	Confident	91.2	Very high	138 Å²	138	57 Å²	57	54%	0.541	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.1	-174.2	-63.1	-73	0	0	0	113.7	F520 R521 L525 L528	F520-Y523 HydrophobicContact CD1-CD1 4.41Å; F520-Y523 HydrophobicContact CD1-CE1 4.05Å; F520-Y523 AromaticContact CE1-CD1 3.97Å; F520-Y523 HydrophobicContact CE1-CD1 3.97Å; F520-Y523 HydrophobicContact CE1-CE1 4.05Å; F520-Y523 HydrophobicContact CE1-CG 4.43Å; R521-Y523 VanDerWaalsContact C-N 3.33Å; R521-Y523 PolarHBondContact O-N 3.1Å; Y523-L525 PolarHBondContact O-N 2.98Å; Y523-L528 HydrophobicContact CE1-CB 4.38Å
524	E	87.7	Confident	91.3	Very high	7 Å²	7	59.4 Å²	59.4	3%	0.033	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.1	173.8	79.3	-73.1	177.6	0	0	114	L320 R491 Y495 S522	L320-E524 HydrophobicContact CB-CB 4.32Å; L320-E524 VanDerWaalsContact CD1-OE2 3.29Å; L320-E524 WeakPolarHBondContact CD1-OE2 3.16Å; R491-E524 WeakPolarHBondContact CD-OE1 3.32Å; Y495-E524 VanDerWaalsContact CE2-OE1 3.29Å; Y495-E524 WeakPolarHBondContact CE2-OE1 3.47Å; Y495-E524 VanDerWaalsContact OH-CG 3.31Å; Y495-E524 WeakPolarHBondContact OH-CG 3.45Å; Y495-E524 PolarHBondContact OH-OE1 3.49Å; S522-E524 WeakPolarHBondContact CA-OE2 3.4Å; S522-E524 PolarHBondContact O-N 3.31Å
525	L	87.8	Confident	91.3	Very high	7 Å²	7	55.6 Å²	55.6	4%	0.037	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-43.1	177.7	-176.4	61.9	0	0	0	112.1	M326 M461 Y495 Y498 S522 Y523	M326-L525 HydrophobicContact CE-CD1 4.17Å; M461-L525 HydrophobicContact SD-CD1 4.15Å; Y495-L525 HydrophobicContact CD1-CD2 4.46Å; Y495-L525 HydrophobicContact CD2-CD2 3.9Å; Y495-L525 HydrophobicContact CE2-CB 4.41Å; Y495-L525 HydrophobicContact CE2-CD2 4.13Å; Y495-L525 HydrophobicContact CG-CD2 4.1Å; Y498-L525 HydrophobicContact CD1-CD1 3.89Å; Y498-L525 HydrophobicContact CD1-CD2 4.3Å; Y498-L525 HydrophobicContact CD1-CG 4.42Å; Y498-L525 HydrophobicContact CE1-CD1 4.08Å; Y498-L525 HydrophobicContact CG-CD1 4.44Å; Y498-L525 HydrophobicContact CG-CD2 4.19Å; S522-L525 PolarHBondContact O-N 3.1Å; Y523-L525 PolarHBondContact O-N 2.98Å
526	M	88.4	Confident	91.4	Very high	11 Å²	11	55.9 Å²	55.9	5%	0.054	29%	0.289	C	S	.	.			trans	-163.3	160.8	178.5	65.2	-171.6	79.5	0	0	112	Y498 F520 S522 N530 M531 Y534	Y498-M526 HydrophobicContact CD2-CE 3.43Å; Y498-M526 VanDerWaalsContact CD2-CE 3.43Å; Y498-M526 HydrophobicContact CE2-CE 4.14Å; Y498-M526 HydrophobicContact CG-CE 3.87Å; F520-M526 WeakPolarHBondContact CE1-O 3.34Å; F520-M526 HydrophobicContact CE2-CG 4.3Å; F520-M526 HydrophobicContact CZ-CG 3.78Å; F520-M526 WeakPolarHBondContact CZ-O 3.46Å; S522-M526 PolarHBondContact O-N 3.03Å; M526-N530 HydrophobicContact CB-CB 4.26Å; M526-M531 HydrophobicContact CG-CB 4.08Å; M526-M531 VanDerWaalsContact SD-CA 3.56Å; M526-M531 HydrophobicContact SD-CB 3.64Å; M526-M531 HydrophobicContact SD-CG 4.05Å; M526-Y534 HydrophobicContact CE-CD2 4.21Å; M526-Y534 HydrophobicContact CE-CE2 4.36Å; M526-Y534 HydrophobicContact SD-CD2 3.68Å; M526-Y534 HydrophobicContact SD-CE2 3.95Å
527	T	91.3	Very high	91.4	Very high	63 Å²	63	59.5 Å²	59.5	39%	0.387	31%	0.308	S	S	.	.			trans	-69.9	156.1	169	61.6	0	0	0	0	111.7	E529 N530 M531	T527-E529 VanDerWaalsContact C-N 3.26Å; T527-E529 PolarHBondContact O-N 3.26Å; T527-N530 PolarHBondContact O-N 3.28Å; T527-N530 PolarHBondContact OG1-N 2.96Å; T527-N530 PolarHBondContact OG1-ND2 3Å; T527-M531 PolarHBondContact O-N 3.03Å
528	L	92.2	Very high	91.5	Very high	75 Å²	75	56.6 Å²	56.6	39%	0.393	29%	0.29	S	S	.	.	H	α-helix	trans	-56	-40.5	176.3	178.9	62.1	0	0	0	112.2	F520 Y523 M531 V532	F520-L528 HydrophobicContact CB-CD1 4Å; F520-L528 HydrophobicContact CD1-CB 4.48Å; F520-L528 HydrophobicContact CD1-CD1 4.1Å; F520-L528 HydrophobicContact CG-CD1 4.29Å; Y523-L528 HydrophobicContact CE1-CB 4.38Å; L528-M531 HydrophobicContact CD1-CE 3.66Å; L528-M531 PolarHBondContact O-N 3.14Å; L528-V532 HydrophobicContact CD1-CG2 4.32Å; L528-V532 WeakPolarHBondContact O-CG2 3.35Å; L528-V532 PolarHBondContact O-N 2.92Å
529	E	93.4	Very high	91.6	Very high	160 Å²	160	51.9 Å²	51.9	75%	0.748	26%	0.258	S	S	*	.	H	α-helix	trans	-59.8	-45.9	177.3	-60.6	177.5	164.4	0	0	112	T527 V532 L533	T527-E529 VanDerWaalsContact C-N 3.26Å; T527-E529 PolarHBondContact O-N 3.26Å; E529-V532 PolarHBondContact O-N 3.33Å; E529-L533 WeakPolarHBondContact O-CB 3.35Å; E529-L533 PolarHBondContact O-N 2.95Å
530	N	92.7	Very high	91.7	Very high	46 Å²	46	52.4 Å²	52.4	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-39.6	175.5	-80.8	-56.6	0	0	0	111.4	M526 T527 L533 Y534	M526-N530 HydrophobicContact CB-CB 4.26Å; T527-N530 PolarHBondContact O-N 3.28Å; T527-N530 PolarHBondContact OG1-N 2.96Å; T527-N530 PolarHBondContact OG1-ND2 3Å; N530-L533 PolarHBondContact O-N 3.2Å; N530-Y534 HydrophobicContact CB-CE2 4.12Å; N530-Y534 WeakPolarHBondContact O-CB 3.29Å; N530-Y534 VanDerWaalsContact O-CD2 3.23Å; N530-Y534 WeakPolarHBondContact O-CD2 3.42Å; N530-Y534 PolarHBondContact O-N 2.97Å
531	M	93.2	Very high	91.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-47	176.5	-170.2	-82.1	-63.8	0	0	111.9	L513 L516 F520 M526 T527 L528 Y534 A535	L513-M531 HydrophobicContact CD2-CG 4.38Å; L516-M531 HydrophobicContact CB-CE 4.46Å; L516-M531 HydrophobicContact CB-SD 4.24Å; F520-M531 HydrophobicContact CB-CE 3.66Å; F520-M531 HydrophobicContact CD2-CB 4.3Å; F520-M531 HydrophobicContact CD2-CE 3.96Å; F520-M531 HydrophobicContact CD2-CG 3.71Å; F520-M531 HydrophobicContact CD2-SD 4.44Å; F520-M531 HydrophobicContact CE2-CB 4.1Å; F520-M531 HydrophobicContact CE2-CG 3.73Å; F520-M531 HydrophobicContact CG-CE 3.86Å; F520-M531 HydrophobicContact CG-CG 4.38Å; F520-M531 HydrophobicContact CZ-CB 4.3Å; F520-M531 HydrophobicContact CZ-CG 4.43Å; M526-M531 HydrophobicContact CG-CB 4.08Å; M526-M531 VanDerWaalsContact SD-CA 3.56Å; M526-M531 HydrophobicContact SD-CB 3.64Å; M526-M531 HydrophobicContact SD-CG 4.05Å; T527-M531 PolarHBondContact O-N 3.03Å; L528-M531 HydrophobicContact CD1-CE 3.66Å; L528-M531 PolarHBondContact O-N 3.14Å; M531-Y534 PolarHBondContact O-N 3.12Å; M531-A535 WeakPolarHBondContact O-CB 3.13Å; M531-A535 PolarHBondContact O-N 2.91Å
532	V	94.8	Very high	91.5	Very high	63 Å²	63	49.8 Å²	49.8	38%	0.382	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-42.6	177.1	174.1	0	0	0	0	111.3	L528 E529 Y534 A535 V536	L528-V532 HydrophobicContact CD1-CG2 4.32Å; L528-V532 WeakPolarHBondContact O-CG2 3.35Å; L528-V532 PolarHBondContact O-N 2.92Å; E529-V532 PolarHBondContact O-N 3.33Å; V532-Y534 VanDerWaalsContact C-N 3.34Å; V532-Y534 PolarHBondContact O-N 2.88Å; V532-A535 PolarHBondContact O-N 3.26Å; V532-V536 WeakPolarHBondContact O-CG2 3.14Å; V532-V536 PolarHBondContact O-N 3.12Å
533	L	94.6	Very high	90.8	Very high	90 Å²	90	53.6 Å²	53.6	47%	0.471	29%	0.285	S	S	.	.	H	α-helix	trans	-58.2	-45.7	174.4	176.9	61.7	0	0	0	111.6	E529 N530 V536 I537	E529-L533 WeakPolarHBondContact O-CB 3.35Å; E529-L533 PolarHBondContact O-N 2.95Å; N530-L533 PolarHBondContact O-N 3.2Å; L533-V536 PolarHBondContact O-N 2.89Å; L533-I537 HydrophobicContact CD1-CD1 3.88Å; L533-I537 HydrophobicContact CD1-CG1 4.4Å; L533-I537 HydrophobicContact CG-CD1 3.92Å; L533-I537 VanDerWaalsContact O-CG1 3.28Å; L533-I537 WeakPolarHBondContact O-CG1 3.24Å; L533-I537 PolarHBondContact O-N 2.95Å
534	Y	94.1	Very high	89.6	Confident	52 Å²	52	51.4 Å²	51.4	20%	0.204	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-37.8	177.4	-64	-18.2	0	0	0	112.6	Y498 M501 M526 N530 M531 V532 I537 A538	Y498-Y534 HydrophobicContact CE2-CE2 4.4Å; M501-Y534 HydrophobicContact CE-CD2 3.76Å; M501-Y534 HydrophobicContact CE-CG 3.89Å; M501-Y534 HydrophobicContact SD-CG 4.25Å; M526-Y534 HydrophobicContact CE-CD2 4.21Å; M526-Y534 HydrophobicContact CE-CE2 4.36Å; M526-Y534 HydrophobicContact SD-CD2 3.68Å; M526-Y534 HydrophobicContact SD-CE2 3.95Å; N530-Y534 HydrophobicContact CB-CE2 4.12Å; N530-Y534 WeakPolarHBondContact O-CB 3.29Å; N530-Y534 VanDerWaalsContact O-CD2 3.23Å; N530-Y534 WeakPolarHBondContact O-CD2 3.42Å; N530-Y534 PolarHBondContact O-N 2.97Å; M531-Y534 PolarHBondContact O-N 3.12Å; V532-Y534 VanDerWaalsContact C-N 3.34Å; V532-Y534 PolarHBondContact O-N 2.88Å; Y534-I537 PolarHBondContact O-N 2.94Å; Y534-A538 VanDerWaalsContact O-CB 3.25Å; Y534-A538 WeakPolarHBondContact O-CB 3.48Å; Y534-A538 PolarHBondContact O-N 2.72Å
535	A	93.6	Very high	88.2	Confident	2 Å²	2	56.7 Å²	56.7	2%	0.017	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-44.4	174	0	0	0	0	0	111.5	L513 T517 M531 V532 S539	L513-A535 HydrophobicContact CB-CB 3.77Å; T517-A535 HydrophobicContact CG2-CB 4.5Å; M531-A535 WeakPolarHBondContact O-CB 3.13Å; M531-A535 PolarHBondContact O-N 2.91Å; V532-A535 PolarHBondContact O-N 3.26Å; A535-S539 VanDerWaalsContact O-CB 3.26Å; A535-S539 WeakPolarHBondContact O-CB 3.46Å; A535-S539 PolarHBondContact O-N 2.61Å; A535-S539 PolarHBondContact O-OG 3.01Å
536	V	94.2	Very high	86.5	Confident	91 Å²	91	64.5 Å²	64.5	55%	0.552	35%	0.348	S	S	*	.	H	α-helix	trans	-64.3	-46	176.1	171.5	0	0	0	0	111.2	V532 L533 S539 A540	V532-V536 WeakPolarHBondContact O-CG2 3.14Å; V532-V536 PolarHBondContact O-N 3.12Å; L533-V536 PolarHBondContact O-N 2.89Å; V536-S539 PolarHBondContact O-N 3.06Å; V536-A540 VanDerWaalsContact O-CB 3.26Å; V536-A540 WeakPolarHBondContact O-CB 3.46Å; V536-A540 PolarHBondContact O-N 3.02Å
537	I	94.1	Very high	84.3	Confident	76 Å²	76	75.4 Å²	75.4	39%	0.39	40%	0.396	S	S	.	.	H	α-helix	trans	-63.6	-46.5	178.2	-69.2	166.9	0	0	0	111.2	L533 Y534 S539 A540 I541	L533-I537 HydrophobicContact CD1-CD1 3.88Å; L533-I537 HydrophobicContact CD1-CG1 4.4Å; L533-I537 HydrophobicContact CG-CD1 3.92Å; L533-I537 VanDerWaalsContact O-CG1 3.28Å; L533-I537 WeakPolarHBondContact O-CG1 3.24Å; L533-I537 PolarHBondContact O-N 2.95Å; Y534-I537 PolarHBondContact O-N 2.94Å; I537-S539 PolarHBondContact O-N 3.4Å; I537-A540 PolarHBondContact O-N 3.32Å; I537-I541 HydrophobicContact CG2-CD1 3.78Å; I537-I541 WeakPolarHBondContact O-CG1 3.49Å; I537-I541 PolarHBondContact O-N 3.02Å
538	A	93	Very high	83.9	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.008	40%	0.397	C	S	.	.	H	α-helix	trans	-62.8	-41.9	178.3	0	0	0	0	0	111.6	A509 L513 Y534 I541 G542	A509-A538 HydrophobicContact CB-CB 4.08Å; L513-A538 HydrophobicContact CD1-CB 4.3Å; Y534-A538 VanDerWaalsContact O-CB 3.25Å; Y534-A538 WeakPolarHBondContact O-CB 3.48Å; Y534-A538 PolarHBondContact O-N 2.72Å; A538-I541 PolarHBondContact O-N 3.46Å; A538-G542 PolarHBondContact O-N 3.01Å
539	S	92.3	Very high	83.5	Confident	19 Å²	19	76.1 Å²	76.1	13%	0.133	40%	0.397	C	S	.	.	H	α-helix	trans	-65.7	-41.6	176.5	-56.3	0	0	0	0	112.3	L514 A535 V536 I537 I541 N543	L514-S539 WeakPolarHBondContact CD1-OG 3.49Å; A535-S539 VanDerWaalsContact O-CB 3.26Å; A535-S539 WeakPolarHBondContact O-CB 3.46Å; A535-S539 PolarHBondContact O-N 2.61Å; A535-S539 PolarHBondContact O-OG 3.01Å; V536-S539 PolarHBondContact O-N 3.06Å; I537-S539 PolarHBondContact O-N 3.4Å; S539-I541 VanDerWaalsContact C-N 3.32Å; S539-I541 PolarHBondContact O-N 2.91Å; S539-N543 VanDerWaalsContact O-CB 3.26Å; S539-N543 WeakPolarHBondContact O-CB 3.42Å; S539-N543 PolarHBondContact O-N 2.79Å
540	A	92.6	Very high	83	Confident	58 Å²	58	71.4 Å²	71.4	48%	0.479	38%	0.377	S	S	.	.	H	α-helix	trans	-67.2	-29.9	177.8	0	0	0	0	0	113.1	V536 I537 V544	V536-A540 VanDerWaalsContact O-CB 3.26Å; V536-A540 WeakPolarHBondContact O-CB 3.46Å; V536-A540 PolarHBondContact O-N 3.02Å; I537-A540 PolarHBondContact O-N 3.32Å; A540-V544 WeakPolarHBondContact O-CB 3.4Å; A540-V544 WeakPolarHBondContact O-CG2 3.3Å
541	I	91.5	Very high	82.4	Confident	77 Å²	77	72.9 Å²	72.9	40%	0.395	39%	0.385	S	S	.	.	H	α-helix	trans	-85.9	-45.7	176.7	-63.9	169.1	0	0	0	111.3	Y506 I537 A538 S539	Y506-I541 HydrophobicContact CD1-CG2 4.48Å; Y506-I541 HydrophobicContact CD2-CB 4.36Å; Y506-I541 HydrophobicContact CD2-CG2 3.46Å; Y506-I541 VanDerWaalsContact CD2-CG2 3.46Å; Y506-I541 HydrophobicContact CE1-CD1 4.26Å; Y506-I541 HydrophobicContact CE2-CG2 3.88Å; Y506-I541 HydrophobicContact CG-CB 4.21Å; Y506-I541 HydrophobicContact CG-CG2 3.78Å; I537-I541 HydrophobicContact CG2-CD1 3.78Å; I537-I541 WeakPolarHBondContact O-CG1 3.49Å; I537-I541 PolarHBondContact O-N 3.02Å; A538-I541 PolarHBondContact O-N 3.46Å; S539-I541 VanDerWaalsContact C-N 3.32Å; S539-I541 PolarHBondContact O-N 2.91Å
542	G	82.9	Confident	81.7	Confident	8 Å²	8	77.5 Å²	77.5	8%	0.082	41%	0.409	C	S	.	.	H	α-helix	trans	-67.8	-48	-176.8	0	0	0	0	0	113.1	A538 V544 V545	A538-G542 PolarHBondContact O-N 3.01Å; G542-V544 VanDerWaalsContact C-N 3.31Å; G542-V544 PolarHBondContact O-N 3.07Å; G542-V545 PolarHBondContact O-N 3.23Å
543	N	72.7	Confident	80.8	Confident	81 Å²	81	78.5 Å²	78.5	43%	0.433	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-77.1	-18.4	-172.7	-58.8	-5.4	0	0	0	112.9	S539 V545 Y546	S539-N543 VanDerWaalsContact O-CB 3.26Å; S539-N543 WeakPolarHBondContact O-CB 3.42Å; S539-N543 PolarHBondContact O-N 2.79Å; N543-V545 PolarHBondContact O-N 2.97Å; N543-Y546 PolarHBondContact O-N 3.33Å
544	V	65.1	Low	79.8	Confident	92 Å²	92	77.6 Å²	77.6	56%	0.558	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-70.5	-13.8	176.9	163.3	0	0	0	0	112.7	A540 G542 Y546 F547	A540-V544 WeakPolarHBondContact O-CB 3.4Å; A540-V544 WeakPolarHBondContact O-CG2 3.3Å; G542-V544 VanDerWaalsContact C-N 3.31Å; G542-V544 PolarHBondContact O-N 3.07Å; V544-Y546 PolarHBondContact O-N 2.74Å; V544-F547 PolarHBondContact O-N 3.18Å
545	V	57	Low	78.7	Confident	119 Å²	119	79.6 Å²	79.6	72%	0.721	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-70.9	-8.9	172.2	-171.7	0	0	0	0	112.5	G542 N543	G542-V545 PolarHBondContact O-N 3.23Å; N543-V545 PolarHBondContact O-N 2.97Å
546	Y	52.6	Low	77.5	Confident	170 Å²	170	86.1 Å²	86.1	67%	0.667	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-103.4	16.4	178.5	-69	-80.7	0	0	0	114.6	N543 V544	N543-Y546 PolarHBondContact O-N 3.33Å; V544-Y546 PolarHBondContact O-N 2.74Å
547	F	42.2	Very low	76	Confident	241 Å²	241	85.6 Å²	85.6	100%	1.057	45%	0.448	S	S	*	.			trans	-123	0	174.5	-74.4	-79.3	0	0	0	112	V544	V544-F547 PolarHBondContact O-N 3.18Å

Retrieved 547 of 547 residues in 81.1 ms (Link to these results)

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