A0A087Y9G5_POEFO Loading...

Prospero homeobox 2

AlphaFold DB , UniProt , Accession A0A087Y9G5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 610 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	37	Very low	231 Å²	231	153 Å²	153	100%	1.138	81%	0.814	S	S	*	*				0	135.3	0	-63.4	170.1	179.7	0	0	106.6
2	N	38.3	Very low	36.2	Very low	153 Å²	153	149.4 Å²	149.4	82%	0.818	81%	0.811	S	S	*	*			trans	59.3	108.2	173.3	-48.4	-15.3	0	0	0	114.2
3	L	34.2	Very low	35.8	Very low	161 Å²	161	145.9 Å²	145.9	84%	0.843	80%	0.804	S	S	*	*			cis	66.7	99.2	31.9	-66.9	170.1	0	0	0	115.7
4	S	36.1	Very low	35.3	Very low	102 Å²	102	143.6 Å²	143.6	71%	0.713	80%	0.803	S	S	*	*				31.6	130.1	127.7	-43.1	0	0	0	0	122
5	L	39.6	Very low	34.9	Very low	162 Å²	162	147 Å²	147	85%	0.848	81%	0.81	S	S	*	*				-171.5	146.3	128.9	-113.2	139.3	0	0	0	113.4
6	P	57.3	Low	34.5	Very low	104 Å²	104	144.5 Å²	144.5	68%	0.675	81%	0.806	S	S	*	*			trans	-114.1	170.4	164.9	40.9	-32.8	0	0	0	113.1
7	D	32.7	Very low	34	Very low	134 Å²	134	142.8 Å²	142.8	72%	0.717	81%	0.805	S	S	*	*			trans	-165.3	153.7	151	-93.3	-35	0	0	0	110.1
8	Q	38.4	Very low	34.2	Very low	159 Å²	159	142.7 Å²	142.7	74%	0.743	80%	0.801	S	S	*	*			cis	111.3	56.7	-3	-165.7	179.2	-132.4	0	0	117.6
9	T	32	Very low	33.9	Very low	136 Å²	136	144.3 Å²	144.3	83%	0.834	80%	0.802	S	S	*	*			trans	-140	129.6	165.5	53.4	0	0	0	0	110.8
10	M	32.9	Very low	33.7	Very low	165 Å²	165	144.7 Å²	144.7	81%	0.813	80%	0.802	S	S	*	*			cis	94.9	147.5	21	-67.3	-67.4	-179.1	0	0	118.1
11	H	33.2	Very low	33.4	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.815	80%	0.804	S	S	*	*			trans	-77.6	167.3	-150.8	-61.9	-85.8	0	0	0	119.3
12	S	27.1	Very low	33.4	Very low	110 Å²	110	143 Å²	143	77%	0.769	79%	0.788	S	S	*	*			trans	-155.3	156.7	138.4	50.8	0	0	0	0	109.5
13	S	31.3	Very low	33.8	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	78%	0.78	S	S	*	*			cis	-167.1	154.2	-23	-88.9	0	0	0	0	110
14	S	29.4	Very low	33.5	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	78%	0.781	S	S	*	*			trans	63.1	153.3	162.5	36.8	0	0	0	0	118.2
15	E	29.6	Very low	33.3	Very low	195 Å²	195	142.4 Å²	142.4	91%	0.911	78%	0.781	S	S	*	*			cis	-144.4	-175.3	11.7	-140.1	166.2	167.3	0	0	112.9
16	S	27.6	Very low	32.9	Very low	107 Å²	107	142 Å²	142	75%	0.748	78%	0.778	S	S	*	*			trans	-108.4	154.2	-158.8	57.7	0	0	0	0	117.5
17	C	27	Very low	31.8	Very low	116 Å²	116	143.9 Å²	143.9	78%	0.784	78%	0.782	S	S	*	*				-172.6	132.1	127.4	-148.7	0	0	0	0	114.5
18	L	37	Very low	31.8	Very low	140 Å²	140	142.5 Å²	142.5	73%	0.733	78%	0.78	S	S	*	*			trans	18.8	128.9	154.2	-55.4	176.1	0	0	0	121.3
19	E	28.2	Very low	31.2	Very low	173 Å²	173	139.7 Å²	139.7	81%	0.808	78%	0.777	S	S	*	*				54	112.5	82.9	-75	-169.6	139.2	0	0	113.9
20	D	29.1	Very low	31.1	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	78%	0.78	S	S	*	*				94.8	108.1	58.7	-169.6	56.5	0	0	0	113.2
21	D	29.4	Very low	30.8	Very low	158 Å²	158	145 Å²	145	85%	0.845	78%	0.779	S	S	*	*			trans	-162.3	177.6	146.2	-147.5	-47.9	0	0	0	108.3
22	K	31.5	Very low	30.5	Very low	183 Å²	183	146.9 Å²	146.9	80%	0.796	78%	0.778	S	S	*	*			trans	-120.1	-143.4	-157.6	-157.6	177.5	-176.7	171.5	0	113
23	P	46.5	Very low	30.4	Very low	102 Å²	102	148.2 Å²	148.2	66%	0.662	78%	0.777	S	S	*	*			trans	-82.1	163.9	-130.7	40.1	-33.8	0	0	0	114.1
24	E	27.7	Very low	30.2	Very low	185 Å²	185	149.8 Å²	149.8	86%	0.864	78%	0.775	S	S	*	*				-167.8	166.8	113.4	-104.6	-166.4	166.2	0	0	116.1
25	V	31.2	Very low	30	Very low	117 Å²	117	153.4 Å²	153.4	71%	0.709	78%	0.779	S	S	*	*			trans	-47.5	148.7	-178.4	-168.2	0	0	0	0	116.1
26	I	31.4	Very low	29.9	Very low	153 Å²	153	153 Å²	153	79%	0.785	78%	0.777	S	S	*	*				175.6	119.5	119.4	-86	159.8	0	0	0	112.5
27	L	33.9	Very low	29.7	Very low	143 Å²	143	154.6 Å²	154.6	75%	0.749	78%	0.777	S	S	*	*			trans	-94.2	140.5	163.6	-89.1	156.7	0	0	0	110
28	P	33.9	Very low	30.1	Very low	106 Å²	106	154 Å²	154	69%	0.688	77%	0.772	S	S	*	*			trans	-97.5	77.1	152.3	-11.2	30.1	0	0	0	111.5	F30	P28-F30 PolarHBondContact O-N 3.41Å
29	C	25.4	Very low	30.2	Very low	100 Å²	100	156 Å²	156	68%	0.676	78%	0.782	S	S	*	*			trans	-66.7	120.5	162	-75.4	0	0	0	0	109	R31	C29-R31 PolarHBondContact O-N 2.72Å
30	F	29.6	Very low	30.3	Very low	203 Å²	203	152.5 Å²	152.5	89%	0.89	78%	0.782	S	S	*	*			trans	-71.2	91.6	176.6	-97.1	-81.8	0	0	0	112.1	P28	P28-F30 PolarHBondContact O-N 3.41Å
31	R	27.1	Very low	30.3	Very low	210 Å²	210	149.9 Å²	149.9	79%	0.792	78%	0.782	S	S	*	*			trans	30.7	90.8	148.5	-74.2	-82.3	-126.6	-160.6	-2.8	116.1	C29 N33	C29-R31 PolarHBondContact O-N 2.72Å; R31-N33 PolarHBondContact O-N 3.02Å
32	R	26.5	Very low	30.7	Very low	214 Å²	214	153.2 Å²	153.2	81%	0.808	78%	0.784	S	S	*	*			trans	-62.5	112.7	148.1	-169.1	-177.3	-152.3	128.8	-1.7	108.1	M34	R32-M34 PolarHBondContact O-N 3.33Å
33	N	24.8	Very low	30.9	Very low	138 Å²	138	148.9 Å²	148.9	74%	0.738	78%	0.777	S	S	*	*			trans	-75.8	117.2	169.2	-97.6	1.6	0	0	0	109	R31	R31-N33 PolarHBondContact O-N 3.02Å
34	M	26.8	Very low	30.9	Very low	138 Å²	138	151.9 Å²	151.9	68%	0.68	79%	0.788	S	S	*	*			trans	-102.7	127.2	162.1	-72.7	-61.4	-167.7	0	0	108.5	R32	R32-M34 PolarHBondContact O-N 3.33Å
35	H	26.6	Very low	31.9	Very low	188 Å²	188	144.8 Å²	144.8	87%	0.87	76%	0.764	S	S	*	*			trans	-121.3	125.3	150.2	-80.5	14.9	0	0	0	105.2
36	E	26.4	Very low	33.3	Very low	186 Å²	186	142.8 Å²	142.8	87%	0.869	76%	0.755	S	S	*	*			trans	-108.7	164.4	175.8	-173	166.6	-150.3	0	0	108.9
37	D	24.2	Very low	35	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	75%	0.749	S	S	*	*			trans	76.3	148.9	168.6	-146.7	50.5	0	0	0	116.6
38	P	35.1	Very low	36.3	Very low	104 Å²	104	140.2 Å²	140.2	68%	0.675	74%	0.741	S	S	*	*			cis	-112.5	171.4	-11	6.5	17.8	0	0	0	115.2	A40	P38-A40 PolarHBondContact O-N 3.25Å
39	L	39.9	Very low	37.4	Very low	182 Å²	182	138 Å²	138	95%	0.953	73%	0.728	S	S	*	*			trans	-52.9	114.1	176.6	-66.3	166.9	0	0	0	113.4
40	A	28.6	Very low	39.1	Very low	98 Å²	98	139.3 Å²	139.3	81%	0.81	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-101.3	126	165.9	0	0	0	0	0	110.5	P38	P38-A40 PolarHBondContact O-N 3.25Å
41	A	30.1	Very low	40.9	Very low	97 Å²	97	135 Å²	135	80%	0.802	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-68.6	156.3	-168.2	0	0	0	0	0	115.1	S43	A41-S43 PolarHBondContact O-N 3.31Å
42	Y	38	Very low	42.4	Very low	229 Å²	229	130.2 Å²	130.2	90%	0.898	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-46.3	131.7	171.5	-80.2	-97.8	0	0	0	112.4
43	S	35.8	Very low	44.2	Very low	91 Å²	91	126.7 Å²	126.7	64%	0.636	69%	0.686	S	S	*	*			trans	-136.1	92.5	173.4	-167.1	0	0	0	0	110.5	A41 G45	A41-S43 PolarHBondContact O-N 3.31Å; S43-G45 PolarHBondContact O-N 2.97Å
44	N	46.6	Very low	45.8	Very low	166 Å²	166	128.2 Å²	128.2	89%	0.888	69%	0.686	S	S	*	*			trans	-73.6	61.1	172.3	-70.8	-26	0	0	0	110.6
45	G	48.6	Very low	47.3	Very low	36 Å²	36	125.8 Å²	125.8	37%	0.371	68%	0.679	S	S	.	*			trans	-97	134.8	-178.3	0	0	0	0	0	112.4	S43	S43-G45 PolarHBondContact O-N 2.97Å
46	S	60.2	Low	48.5	Very low	74 Å²	74	122.4 Å²	122.4	52%	0.517	67%	0.667	S	S	.	*			trans	-53.4	146.3	175.5	178.4	0	0	0	0	112.7	I48 S49	S46-I48 PolarHBondContact O-N 2.94Å; S46-S49 WeakPolarHBondContact O-CB 3.39Å; S46-S49 PolarHBondContact O-N 3.14Å
47	I	66.1	Low	49.7	Very low	130 Å²	130	120.1 Å²	120.1	67%	0.667	66%	0.656	S	S	*	*	H	α-helix	trans	-48.6	-36.6	-179.3	-60.3	172	0	0	0	111.9	S49 Q50 L51	I47-S49 VanDerWaalsContact C-N 3.27Å; I47-S49 PolarHBondContact O-N 3.31Å; I47-Q50 PolarHBondContact O-N 2.9Å; I47-Q50 VanDerWaalsContact O-N 3.1Å; I47-L51 PolarHBondContact O-N 2.82Å; I47-L51 VanDerWaalsContact O-N 3.1Å
48	I	60.9	Low	50.4	Low	113 Å²	113	118.5 Å²	118.5	58%	0.579	65%	0.647	S	S	*	*	H	α-helix	trans	-57	-40.6	177.5	-57.5	173.4	0	0	0	111.2	S46 Q50 L51 L52	S46-I48 PolarHBondContact O-N 2.94Å; I48-Q50 VanDerWaalsContact C-N 3.3Å; I48-Q50 PolarHBondContact O-N 3.2Å; I48-L51 PolarHBondContact O-N 3.33Å; I48-L52 HydrophobicContact CG2-CD1 4.03Å; I48-L52 HydrophobicContact CG2-CG 4.46Å; I48-L52 WeakPolarHBondContact O-CG 3.26Å; I48-L52 PolarHBondContact O-N 3.05Å
49	S	57.9	Low	50.9	Low	59 Å²	59	122.4 Å²	122.4	41%	0.413	65%	0.653	S	S	.	*	H	α-helix	trans	-75.7	-12.7	-179.5	-52.9	0	0	0	0	114	S46 I47 R53	S46-S49 WeakPolarHBondContact O-CB 3.39Å; S46-S49 PolarHBondContact O-N 3.14Å; I47-S49 VanDerWaalsContact C-N 3.27Å; I47-S49 PolarHBondContact O-N 3.31Å; S49-R53 PolarHBondContact O-NE 2.81Å
50	Q	61.8	Low	51.2	Low	128 Å²	128	124.9 Å²	124.9	60%	0.598	65%	0.65	S	S	*	*	H	α-helix	trans	-85.3	-44.7	165.5	-71.1	-171.3	-6.7	0	0	111	I47 I48 L52 R53 K54	I47-Q50 PolarHBondContact O-N 2.9Å; I47-Q50 VanDerWaalsContact O-N 3.1Å; I48-Q50 VanDerWaalsContact C-N 3.3Å; I48-Q50 PolarHBondContact O-N 3.2Å; Q50-L52 PolarHBondContact O-N 2.89Å; Q50-R53 PolarHBondContact O-N 3.13Å; Q50-K54 PolarHBondContact O-N 2.85Å; Q50-K54 VanDerWaalsContact O-N 3.1Å
51	L	66.1	Low	51.8	Low	112 Å²	112	124 Å²	124	59%	0.586	64%	0.643	S	S	*	*	H	α-helix	trans	-57.3	-48.5	178.7	-113.6	73.3	0	0	0	112.2	I47 I48 R53 K54 T55	I47-L51 PolarHBondContact O-N 2.82Å; I47-L51 VanDerWaalsContact O-N 3.1Å; I48-L51 PolarHBondContact O-N 3.33Å; L51-R53 PolarHBondContact O-N 3.02Å; L51-K54 WeakPolarHBondContact O-CB 3.41Å; L51-K54 PolarHBondContact O-N 3.39Å; L51-K54 VanDerWaalsContact O-N 3.12Å; L51-T55 PolarHBondContact O-N 3.48Å; L51-T55 PolarHBondContact O-OG1 3.13Å
52	L	60.2	Low	52.4	Low	109 Å²	109	125.9 Å²	125.9	57%	0.571	64%	0.638	S	S	*	*	H	α-helix	trans	-61.9	-42.5	-178.1	-69.1	172.2	0	0	0	112.5	I48 Q50 K54 T55 I56	I48-L52 HydrophobicContact CG2-CD1 4.03Å; I48-L52 HydrophobicContact CG2-CG 4.46Å; I48-L52 WeakPolarHBondContact O-CG 3.26Å; I48-L52 PolarHBondContact O-N 3.05Å; Q50-L52 PolarHBondContact O-N 2.89Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 2.76Å; L52-T55 PolarHBondContact O-N 3.17Å; L52-I56 WeakPolarHBondContact O-CD1 3.4Å; L52-I56 VanDerWaalsContact O-CG1 3.32Å; L52-I56 WeakPolarHBondContact O-CG1 3.44Å; L52-I56 PolarHBondContact O-N 2.94Å; L52-I56 VanDerWaalsContact O-N 3.14Å
53	R	63	Low	52.4	Low	140 Å²	140	122.7 Å²	122.7	53%	0.528	64%	0.636	S	S	.	*	H	α-helix	trans	-61.2	-39.6	173.9	-81.1	-174.3	-75.8	174	-5.8	112.1	S49 Q50 L51 I56 H57	S49-R53 PolarHBondContact O-NE 2.81Å; Q50-R53 PolarHBondContact O-N 3.13Å; L51-R53 PolarHBondContact O-N 3.02Å; R53-I56 PolarHBondContact O-N 3.44Å; R53-H57 PolarHBondContact O-N 2.99Å; R53-H57 PolarHBondContact O-ND1 3.03Å
54	K	59.7	Low	52.5	Low	170 Å²	170	125.6 Å²	125.6	74%	0.739	65%	0.645	S	S	*	*	H	α-helix	trans	-67.2	-38.7	-180	-155	168.1	-174.1	173.9	0	112.1	Q50 L51 L52 N58	Q50-K54 PolarHBondContact O-N 2.85Å; Q50-K54 VanDerWaalsContact O-N 3.1Å; L51-K54 WeakPolarHBondContact O-CB 3.41Å; L51-K54 PolarHBondContact O-N 3.39Å; L51-K54 VanDerWaalsContact O-N 3.12Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 2.76Å; K54-N58 PolarHBondContact O-N 2.67Å
55	T	56.9	Low	51.9	Low	87 Å²	87	125 Å²	125	53%	0.534	64%	0.642	S	S	.	*	H	α-helix	trans	-66.3	-36.8	174.5	-58.2	0	0	0	0	112.9	L51 L52 K59	L51-T55 PolarHBondContact O-N 3.48Å; L51-T55 PolarHBondContact O-OG1 3.13Å; L52-T55 PolarHBondContact O-N 3.17Å; T55-K59 PolarHBondContact O-N 2.81Å
56	I	52.9	Low	51.3	Low	118 Å²	118	132.3 Å²	132.3	61%	0.605	67%	0.666	S	S	*	*	H	α-helix	trans	-66.5	-43	179.9	-69.6	163.6	0	0	0	111.6	L52 R53 K59	L52-I56 WeakPolarHBondContact O-CD1 3.4Å; L52-I56 VanDerWaalsContact O-CG1 3.32Å; L52-I56 WeakPolarHBondContact O-CG1 3.44Å; L52-I56 PolarHBondContact O-N 2.94Å; L52-I56 VanDerWaalsContact O-N 3.14Å; R53-I56 PolarHBondContact O-N 3.44Å; I56-K59 PolarHBondContact O-N 3.34Å
57	H	52	Low	49.9	Very low	138 Å²	138	137.6 Å²	137.6	64%	0.639	68%	0.68	S	S	*	*	H	α-helix	trans	-67.1	-38.3	179.2	-71	76.9	0	0	0	112.3	R53 K59 R60	R53-H57 PolarHBondContact O-N 2.99Å; R53-H57 PolarHBondContact O-ND1 3.03Å; H57-K59 PolarHBondContact O-N 2.78Å; H57-R60 PolarHBondContact O-N 2.71Å; H57-R60 VanDerWaalsContact O-N 3.1Å
58	N	38.8	Very low	48.1	Very low	108 Å²	108	141.4 Å²	141.4	58%	0.578	69%	0.687	S	S	*	*	H	α-helix	trans	-60.5	-28.2	177.8	-162.4	23.5	0	0	0	112.8	K54 R60	K54-N58 PolarHBondContact O-N 2.67Å; N58-R60 VanDerWaalsContact C-N 3.3Å; N58-R60 PolarHBondContact O-N 2.87Å
59	K	45.8	Very low	46.6	Very low	186 Å²	186	144.3 Å²	144.3	81%	0.809	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-2.6	177.2	-88.9	-156.2	170.9	-163.5	0	115.5	T55 I56 H57	T55-K59 PolarHBondContact O-N 2.81Å; I56-K59 PolarHBondContact O-N 3.34Å; H57-K59 PolarHBondContact O-N 2.78Å
60	R	44.3	Very low	45.1	Very low	234 Å²	234	146.7 Å²	146.7	88%	0.883	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	10.5	176.7	-160.4	179.6	-85.4	-168.8	-6.8	113.2	H57 N58	H57-R60 PolarHBondContact O-N 2.71Å; H57-R60 VanDerWaalsContact O-N 3.1Å; N58-R60 VanDerWaalsContact C-N 3.3Å; N58-R60 PolarHBondContact O-N 2.87Å
61	A	41.4	Very low	43.4	Very low	80 Å²	80	148.8 Å²	148.8	66%	0.661	74%	0.735	S	S	*	*	S	Bend	trans	-120.3	21.6	-175.5	0	0	0	0	0	113.6
62	I	44.4	Very low	41.9	Very low	136 Å²	136	148.3 Å²	148.3	70%	0.697	74%	0.741	S	S	*	*	S	Bend	trans	-113.5	-10.5	-173.4	-72	174.2	0	0	0	112.4
63	D	36	Very low	40.6	Very low	161 Å²	161	149.6 Å²	149.6	86%	0.861	75%	0.753	S	S	*	*	S	Bend	trans	-116.9	25.1	-167.7	-142.2	18.5	0	0	0	112.6
64	D	39.5	Very low	39.1	Very low	153 Å²	153	147.1 Å²	147.1	82%	0.818	76%	0.762	S	S	*	*	S	Bend	trans	-159.2	61.2	-177.7	-116.1	-28	0	0	0	112.3
65	N	32.9	Very low	37.8	Very low	154 Å²	154	144.2 Å²	144.2	82%	0.824	77%	0.77	S	S	*	*			trans	-173	90.5	154.7	-109.5	-45	0	0	0	112.8
66	H	36.6	Very low	36.6	Very low	189 Å²	189	145.1 Å²	145.1	88%	0.875	79%	0.787	S	S	*	*			trans	-147.7	63.5	169.7	-112	-72.3	0	0	0	111.7
67	F	30	Very low	35.5	Very low	184 Å²	184	147 Å²	147	81%	0.807	80%	0.798	S	S	*	*			trans	-156	155.3	159	-107.3	-71.5	0	0	0	112.2
68	Y	28.1	Very low	34.5	Very low	211 Å²	211	146 Å²	146	83%	0.827	81%	0.806	S	S	*	*			trans	57	93.2	175.4	-69.9	-76.9	0	0	0	118.9
69	L	30.8	Very low	34.1	Very low	174 Å²	174	144.2 Å²	144.2	91%	0.911	81%	0.813	S	S	*	*			trans	-146.1	84.9	144.5	-115	176.7	0	0	0	110
70	S	26.9	Very low	33.5	Very low	109 Å²	109	142.9 Å²	142.9	76%	0.762	81%	0.81	S	S	*	*			trans	-165.5	106.2	164.1	-79.5	0	0	0	0	111.1
71	N	26	Very low	33.1	Very low	171 Å²	171	139.2 Å²	139.2	91%	0.914	80%	0.803	S	S	*	*				-156.6	174.1	102.4	-119.3	4.8	0	0	0	111.6
72	S	34.5	Very low	32.7	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	81%	0.81	S	S	*	*			trans	-119.2	178.2	-171.4	-173.7	0	0	0	0	110.3
73	V	31.7	Very low	32.1	Very low	136 Å²	136	142.3 Å²	142.3	82%	0.824	81%	0.81	S	S	*	*				166.8	151.5	120.3	157	0	0	0	0	110.3
74	A	32.8	Very low	32.1	Very low	87 Å²	87	139 Å²	139	72%	0.719	80%	0.8	S	S	*	*			trans	-81.2	161	179.1	0	0	0	0	0	112.7
75	A	32	Very low	31.8	Very low	110 Å²	110	137.4 Å²	137.4	91%	0.909	80%	0.795	S	S	*	*			trans	-78	129.3	167	0	0	0	0	0	110.8
76	A	32.3	Very low	32.1	Very low	106 Å²	106	136.9 Å²	136.9	88%	0.876	79%	0.791	S	S	*	*			trans	-137.4	147.3	160.8	0	0	0	0	0	107.4
77	D	28.7	Very low	31.9	Very low	157 Å²	157	136.7 Å²	136.7	84%	0.84	79%	0.791	S	S	*	*			trans	-111	145.8	-171.5	-176.9	28.7	0	0	0	111.8
78	S	31.9	Very low	32.1	Very low	116 Å²	116	131.3 Å²	131.3	81%	0.811	78%	0.78	S	S	*	*			trans	55.3	120.1	172.4	-158.7	0	0	0	0	118.4
79	G	30.6	Very low	32.1	Very low	71 Å²	71	128.2 Å²	128.2	73%	0.732	78%	0.783	S	S	*	*			cis	167.6	-164.7	-2.5	0	0	0	0	0	113.9
80	Q	32.9	Very low	32	Very low	159 Å²	159	125.1 Å²	125.1	74%	0.743	78%	0.776	S	S	*	*			trans	91.1	107	167.3	-156.2	165.4	10.7	0	0	119.1
81	E	34.8	Very low	33.5	Very low	157 Å²	157	125.2 Å²	125.2	73%	0.734	77%	0.774	S	S	*	*			trans	63.4	141.6	146.9	-69.9	157.5	-141.7	0	0	119.7
82	D	34	Very low	33.6	Very low	149 Å²	149	121.9 Å²	121.9	80%	0.797	76%	0.764	S	S	*	*			cis	-160.8	170.6	-10	-139.2	-12.7	0	0	0	112.9
83	D	31	Very low	33.4	Very low	131 Å²	131	122.5 Å²	122.5	70%	0.701	76%	0.759	S	S	*	*			trans	50.9	120.8	154.4	-155.6	59.1	0	0	0	125.4
84	S	36.5	Very low	33.5	Very low	93 Å²	93	124.2 Å²	124.2	65%	0.65	76%	0.758	S	S	*	*			trans	48.4	168.3	137.5	98.1	0	0	0	0	123.4
85	T	32.7	Very low	33.5	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.724	76%	0.763	S	S	*	*			cis	-157.3	156	-9.5	-148.2	0	0	0	0	113.8
86	I	38.8	Very low	33.6	Very low	143 Å²	143	126 Å²	126	73%	0.733	75%	0.753	S	S	*	*			trans	8.5	141	167.2	52	169	0	0	0	126.6
87	E	32.5	Very low	33.6	Very low	186 Å²	186	127.6 Å²	127.6	87%	0.869	75%	0.751	S	S	*	*			trans	55.2	161.4	138.6	-67.1	-145	145.7	0	0	123.4
88	A	33.7	Very low	33.7	Very low	71 Å²	71	123.3 Å²	123.3	59%	0.587	75%	0.745	S	S	*	*			cis	-172.7	175.1	-30	0	0	0	0	0	111.6
89	V	29.1	Very low	33.8	Very low	145 Å²	145	125 Å²	125	88%	0.879	75%	0.75	S	S	*	*			trans	78.9	150.3	161.5	-176	0	0	0	0	119.9
90	S	29.8	Very low	34.1	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	75%	0.751	S	S	*	*			trans	-105.9	-155.5	-173.1	-40.8	0	0	0	0	112
91	P	57.2	Low	34.7	Very low	111 Å²	111	124.1 Å²	124.1	72%	0.721	75%	0.747	S	S	*	*			cis	-139.2	-160.4	-10	40.8	-19.2	0	0	0	115.4
92	S	28.3	Very low	35	Very low	100 Å²	100	125.9 Å²	125.9	70%	0.699	76%	0.756	S	S	*	*			trans	75.5	151.4	153	-73.9	0	0	0	0	119.7
93	D	30.4	Very low	35	Very low	117 Å²	117	121.9 Å²	121.9	63%	0.626	75%	0.749	S	S	*	*			cis	-170.5	177.2	-14.2	-119.4	-59.1	0	0	0	112.4
94	H	34.4	Very low	35.2	Very low	171 Å²	171	123.9 Å²	123.9	79%	0.792	76%	0.76	S	S	*	*			trans	72	165.1	161	-46.3	-43.1	0	0	0	119.7
95	V	31.6	Very low	35.6	Very low	136 Å²	136	127.7 Å²	127.7	82%	0.824	77%	0.767	S	S	*	*				-164.6	156.5	-52.4	119.2	0	0	0	0	111.9
96	S	34.5	Very low	36.5	Very low	100 Å²	100	128.1 Å²	128.1	70%	0.699	77%	0.772	S	S	*	*			trans	85.4	112.4	157.7	-111.8	0	0	0	0	125
97	T	31.9	Very low	37.4	Very low	138 Å²	138	126.3 Å²	126.3	85%	0.847	76%	0.763	S	S	*	*				58.8	114.2	116.1	-42.9	0	0	0	0	123.7
98	G	32.2	Very low	39.2	Very low	68 Å²	68	121.3 Å²	121.3	70%	0.701	75%	0.747	S	S	*	*				139.2	122.3	128.8	0	0	0	0	0	121.8
99	V	34	Very low	41.1	Very low	152 Å²	152	123.8 Å²	123.8	92%	0.921	75%	0.75	S	S	*	*			trans	84.5	139.7	153.3	-173.5	0	0	0	0	120.7
100	S	35.5	Very low	43.5	Very low	108 Å²	108	123.7 Å²	123.7	76%	0.755	74%	0.74	S	S	*	*			trans	-50.3	173.1	174.6	-96.2	0	0	0	0	118.5
101	P	46.6	Very low	46	Very low	102 Å²	102	123 Å²	123	66%	0.662	73%	0.727	S	S	*	*			cis	-134.4	176.4	14.1	41.2	-23.8	0	0	0	118.2
102	E	39.8	Very low	47.2	Very low	195 Å²	195	124.5 Å²	124.5	91%	0.911	72%	0.722	S	S	*	*			trans	12.6	123.4	153.1	-66.7	163.4	119.4	0	0	121.1
103	G	33.8	Very low	49.8	Very low	64 Å²	64	122.6 Å²	122.6	66%	0.66	71%	0.713	S	S	*	*			trans	-149.3	109.1	160.2	0	0	0	0	0	110.9	H105	G103-H105 PolarHBondContact O-N 2.79Å
104	D	35.6	Very low	52.5	Low	174 Å²	174	123.2 Å²	123.2	93%	0.93	71%	0.71	S	S	*	*			trans	-73.6	108.5	-175.3	-117.8	-22.7	0	0	0	111.5
105	H	45.2	Very low	55	Low	173 Å²	173	122.7 Å²	122.7	80%	0.801	70%	0.701	S	S	*	*			trans	-78.2	126.8	174.2	-70	-64.4	0	0	0	110.9	G103 L107	G103-H105 PolarHBondContact O-N 2.79Å; H105-L107 PolarHBondContact O-N 3.34Å
106	P	51.8	Low	57.8	Low	127 Å²	127	118.9 Å²	118.9	83%	0.825	68%	0.684	S	S	*	*			trans	-59.6	106.1	-179.6	-27.1	36.2	0	0	0	113.1	P108	P106-P108 WeakPolarHBondContact O-CD 3.44Å
107	L	58.4	Low	60.3	Low	104 Å²	104	123.5 Å²	123.5	55%	0.545	69%	0.686	S	S	.	*			trans	-66.2	118.8	-177.5	-152.1	167.6	0	0	0	109.6	H105 D109 L111	H105-L107 PolarHBondContact O-N 3.34Å; L107-D109 PolarHBondContact O-N 3.4Å; L107-L111 HydrophobicContact CD2-CB 3.49Å; L107-L111 VanDerWaalsContact CD2-CB 3.49Å; L107-L111 HydrophobicContact CD2-CD1 3.65Å; L107-L111 HydrophobicContact CD2-CG 4.21Å
108	P	70.3	Confident	63.2	Low	81 Å²	81	120.6 Å²	120.6	53%	0.526	67%	0.668	S	S	.	*			trans	-49.5	136.2	-166.4	-33.3	34.7	0	0	0	115.5	P106 H110 L111 K112	P106-P108 WeakPolarHBondContact O-CD 3.44Å; P108-H110 PolarHBondContact O-N 3.22Å; P108-L111 WeakPolarHBondContact O-CA 3.04Å; P108-L111 WeakPolarHBondContact O-CB 3.19Å; P108-L111 PolarHBondContact O-N 3.33Å; P108-K112 PolarHBondContact O-N 3.17Å
109	D	73.9	Confident	65.9	Low	123 Å²	123	121.4 Å²	121.4	66%	0.658	65%	0.653	S	S	*	*	H	α-helix	trans	-56.2	-29.2	-174	-80.8	-51.2	0	0	0	114.1	L107 L111 K112 A113	L107-D109 PolarHBondContact O-N 3.4Å; D109-L111 VanDerWaalsContact C-N 3.3Å; D109-L111 PolarHBondContact O-N 2.58Å; D109-K112 PolarHBondContact O-N 3.26Å; D109-A113 VanDerWaalsContact O-CB 3.3Å; D109-A113 WeakPolarHBondContact O-CB 3.38Å; D109-A113 PolarHBondContact O-N 3.33Å
110	H	78.6	Confident	68.2	Low	144 Å²	144	118.5 Å²	118.5	67%	0.667	63%	0.633	S	S	*	*	H	α-helix	trans	-57.6	-43	171.8	-175	-14	0	0	0	111.7	P108 K114	P108-H110 PolarHBondContact O-N 3.22Å; H110-K114 WeakPolarHBondContact O-CB 3.02Å; H110-K114 PolarHBondContact O-N 2.69Å
111	L	81.9	Confident	70.4	Confident	95 Å²	95	117.6 Å²	117.6	50%	0.497	62%	0.618	S	S	.	*	H	α-helix	trans	-71.9	-37.1	179.1	-69.3	166.3	0	0	0	111.2	L107 P108 D109 K114 R115	L107-L111 HydrophobicContact CD2-CB 3.49Å; L107-L111 VanDerWaalsContact CD2-CB 3.49Å; L107-L111 HydrophobicContact CD2-CD1 3.65Å; L107-L111 HydrophobicContact CD2-CG 4.21Å; P108-L111 WeakPolarHBondContact O-CA 3.04Å; P108-L111 WeakPolarHBondContact O-CB 3.19Å; P108-L111 PolarHBondContact O-N 3.33Å; D109-L111 VanDerWaalsContact C-N 3.3Å; D109-L111 PolarHBondContact O-N 2.58Å; L111-K114 PolarHBondContact O-N 2.99Å; L111-R115 WeakPolarHBondContact O-CB 3.49Å; L111-R115 PolarHBondContact O-N 3.26Å
112	K	83.2	Confident	72.1	Confident	142 Å²	142	117.7 Å²	117.7	62%	0.617	61%	0.612	S	S	*	*	H	α-helix	trans	-62.5	-47.3	173.2	-168.5	175.1	-178.9	178.2	0	111.9	P108 D109 K114 R115 A116	P108-K112 PolarHBondContact O-N 3.17Å; D109-K112 PolarHBondContact O-N 3.26Å; K112-K114 PolarHBondContact O-N 3.04Å; K112-R115 PolarHBondContact O-N 3.35Å; K112-A116 WeakPolarHBondContact O-CB 3.3Å; K112-A116 PolarHBondContact O-N 3.35Å
113	A	82.4	Confident	74.3	Confident	61 Å²	61	115.9 Å²	115.9	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-64.5	-37.3	174.6	0	0	0	0	0	112.4	D109 R117	D109-A113 VanDerWaalsContact O-CB 3.3Å; D109-A113 WeakPolarHBondContact O-CB 3.38Å; D109-A113 PolarHBondContact O-N 3.33Å; A113-R117 WeakPolarHBondContact O-CB 3.44Å; A113-R117 PolarHBondContact O-N 3.21Å
114	K	87.6	Confident	76.2	Confident	129 Å²	129	118 Å²	118	56%	0.561	60%	0.597	S	S	*	*	H	α-helix	trans	-67	-42.4	175.6	-163.4	174.4	-172.9	179.5	0	111.2	H110 L111 K112 R117 V118	H110-K114 WeakPolarHBondContact O-CB 3.02Å; H110-K114 PolarHBondContact O-N 2.69Å; L111-K114 PolarHBondContact O-N 2.99Å; K112-K114 PolarHBondContact O-N 3.04Å; K114-R117 PolarHBondContact O-N 3.17Å; K114-V118 WeakPolarHBondContact O-CG2 3.41Å; K114-V118 PolarHBondContact O-N 3.49Å
115	R	87.1	Confident	77.6	Confident	161 Å²	161	116.9 Å²	116.9	61%	0.608	59%	0.588	S	S	*	*	H	α-helix	trans	-60.8	-52.9	172.6	-175.9	-175.1	-70.8	-171	-0.6	111	L111 K112 R117 V118 E119	L111-R115 WeakPolarHBondContact O-CB 3.49Å; L111-R115 PolarHBondContact O-N 3.26Å; K112-R115 PolarHBondContact O-N 3.35Å; R115-R117 VanDerWaalsContact C-N 3.27Å; R115-R117 PolarHBondContact O-N 3.48Å; R115-V118 PolarHBondContact O-N 2.87Å; R115-E119 WeakPolarHBondContact CD-OE1 3.49Å; R115-E119 HydrophobicContact CG-CG 4.42Å; R115-E119 VanDerWaalsContact CG-OE1 3.31Å; R115-E119 WeakPolarHBondContact CG-OE1 3.18Å; R115-E119 PolarHBondContact O-N 2.75Å
116	A	89.6	Confident	78.6	Confident	56 Å²	56	112.3 Å²	112.3	46%	0.463	58%	0.58	S	S	.	*	H	α-helix	trans	-57.9	-38.1	179.3	0	0	0	0	0	112.7	K112 N120	K112-A116 WeakPolarHBondContact O-CB 3.3Å; K112-A116 PolarHBondContact O-N 3.35Å; A116-N120 WeakPolarHBondContact O-CB 3.41Å; A116-N120 PolarHBondContact O-N 3.49Å
117	R	88.2	Confident	78.8	Confident	196 Å²	196	109.3 Å²	109.3	74%	0.74	57%	0.572	S	S	*	*	H	α-helix	trans	-68.9	-38.1	175.6	-169	169.6	-176.3	142.1	-0	112.7	A113 K114 R115 I121	A113-R117 WeakPolarHBondContact O-CB 3.44Å; A113-R117 PolarHBondContact O-N 3.21Å; K114-R117 PolarHBondContact O-N 3.17Å; R115-R117 VanDerWaalsContact C-N 3.27Å; R115-R117 PolarHBondContact O-N 3.48Å; R117-I121 HydrophobicContact CG-CD1 4.43Å; R117-I121 WeakPolarHBondContact O-CD1 3.35Å; R117-I121 VanDerWaalsContact O-CG1 3.29Å; R117-I121 WeakPolarHBondContact O-CG1 3.4Å; R117-I121 PolarHBondContact O-N 3.4Å; R117-I121 VanDerWaalsContact O-N 3.12Å
118	V	91.8	Very high	77.8	Confident	77 Å²	77	109.3 Å²	109.3	47%	0.467	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-46.2	173.7	167.9	0	0	0	0	111	K114 R115 N120 I121 I122	K114-V118 WeakPolarHBondContact O-CG2 3.41Å; K114-V118 PolarHBondContact O-N 3.49Å; R115-V118 PolarHBondContact O-N 2.87Å; V118-N120 VanDerWaalsContact C-N 3.3Å; V118-N120 PolarHBondContact O-N 3.23Å; V118-I121 PolarHBondContact O-N 3.11Å; V118-I122 HydrophobicContact CG1-CD1 3.74Å; V118-I122 HydrophobicContact CG1-CG1 4.4Å; V118-I122 WeakPolarHBondContact O-CG1 3.47Å; V118-I122 PolarHBondContact O-N 2.79Å
119	E	88.3	Confident	76.9	Confident	86 Å²	86	111 Å²	111	40%	0.402	59%	0.592	S	S	.	*	H	α-helix	trans	-58.5	-40.4	175	-76	177.2	-154	0	0	112.2	R115 I122 R123	R115-E119 WeakPolarHBondContact CD-OE1 3.49Å; R115-E119 HydrophobicContact CG-CG 4.42Å; R115-E119 VanDerWaalsContact CG-OE1 3.31Å; R115-E119 WeakPolarHBondContact CG-OE1 3.18Å; R115-E119 PolarHBondContact O-N 2.75Å; E119-I122 PolarHBondContact O-N 3.25Å; E119-R123 VanDerWaalsContact O-CB 3.26Å; E119-R123 WeakPolarHBondContact O-CB 3.37Å; E119-R123 PolarHBondContact O-N 3.04Å
120	N	82.2	Confident	74.9	Confident	91 Å²	91	113.2 Å²	113.2	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-69.8	-33.9	178.3	-154.6	56.8	0	0	0	112.3	A116 V118 V124	A116-N120 WeakPolarHBondContact O-CB 3.41Å; A116-N120 PolarHBondContact O-N 3.49Å; V118-N120 VanDerWaalsContact C-N 3.3Å; V118-N120 PolarHBondContact O-N 3.23Å; N120-V124 WeakPolarHBondContact O-CB 3.47Å; N120-V124 VanDerWaalsContact O-CG2 3.29Å; N120-V124 WeakPolarHBondContact O-CG2 3.09Å; N120-V124 PolarHBondContact O-N 3.15Å
121	I	81.6	Confident	72.7	Confident	89 Å²	89	111.9 Å²	111.9	46%	0.456	61%	0.611	S	S	.	*	H	α-helix	trans	-65.2	-47.4	170.9	-69.9	163.2	0	0	0	110.4	R117 V118 R123 V124 M125	R117-I121 HydrophobicContact CG-CD1 4.43Å; R117-I121 WeakPolarHBondContact O-CD1 3.35Å; R117-I121 VanDerWaalsContact O-CG1 3.29Å; R117-I121 WeakPolarHBondContact O-CG1 3.4Å; R117-I121 PolarHBondContact O-N 3.4Å; R117-I121 VanDerWaalsContact O-N 3.12Å; V118-I121 PolarHBondContact O-N 3.11Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 2.91Å; I121-V124 PolarHBondContact O-N 3.3Å; I121-M125 HydrophobicContact CG2-CG 4.43Å; I121-M125 HydrophobicContact CG2-SD 3.75Å; I121-M125 WeakPolarHBondContact O-CB 3.32Å; I121-M125 WeakPolarHBondContact O-CG 3.34Å; I121-M125 PolarHBondContact O-N 3.33Å
122	I	83.4	Confident	70.6	Confident	103 Å²	103	118.3 Å²	118.3	53%	0.528	63%	0.628	S	S	.	*	H	α-helix	trans	-60	-42.3	176.9	-67.9	167.6	0	0	0	110.7	V118 E119 V124 M125 A126	V118-I122 HydrophobicContact CG1-CD1 3.74Å; V118-I122 HydrophobicContact CG1-CG1 4.4Å; V118-I122 WeakPolarHBondContact O-CG1 3.47Å; V118-I122 PolarHBondContact O-N 2.79Å; E119-I122 PolarHBondContact O-N 3.25Å; I122-V124 PolarHBondContact O-N 2.66Å; I122-M125 PolarHBondContact O-N 3.27Å; I122-A126 VanDerWaalsContact O-CB 3.26Å; I122-A126 WeakPolarHBondContact O-CB 3.35Å; I122-A126 PolarHBondContact O-N 2.94Å
123	R	85.8	Confident	68.3	Low	158 Å²	158	120.2 Å²	120.2	60%	0.596	64%	0.639	S	S	*	*	H	α-helix	trans	-66	-35.6	178.5	-168	175.6	-63.3	136.7	6	112.8	E119 I121 G127	E119-R123 VanDerWaalsContact O-CB 3.26Å; E119-R123 WeakPolarHBondContact O-CB 3.37Å; E119-R123 PolarHBondContact O-N 3.04Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 2.91Å; R123-G127 PolarHBondContact O-N 2.93Å
124	V	74.4	Confident	65.9	Low	108 Å²	108	124.7 Å²	124.7	66%	0.655	65%	0.649	S	S	*	*	H	α-helix	trans	-70.9	-39.2	172.2	168.7	0	0	0	0	111.3	N120 I121 I122 G127	N120-V124 WeakPolarHBondContact O-CB 3.47Å; N120-V124 VanDerWaalsContact O-CG2 3.29Å; N120-V124 WeakPolarHBondContact O-CG2 3.09Å; N120-V124 PolarHBondContact O-N 3.15Å; I121-V124 PolarHBondContact O-N 3.3Å; I122-V124 PolarHBondContact O-N 2.66Å; V124-G127 PolarHBondContact O-N 3.28Å
125	M	63.4	Low	63	Low	151 Å²	151	124 Å²	124	74%	0.744	66%	0.66	S	S	*	*	H	α-helix	trans	-71.8	-31.7	177.2	-72.7	174.7	58.8	0	0	113.6	I121 I122 G127	I121-M125 HydrophobicContact CG2-CG 4.43Å; I121-M125 HydrophobicContact CG2-SD 3.75Å; I121-M125 WeakPolarHBondContact O-CB 3.32Å; I121-M125 WeakPolarHBondContact O-CG 3.34Å; I121-M125 PolarHBondContact O-N 3.33Å; I122-M125 PolarHBondContact O-N 3.27Å; M125-G127 VanDerWaalsContact C-N 3.25Å; M125-G127 PolarHBondContact O-N 3.28Å
126	A	67.9	Low	60.3	Low	76 Å²	76	122.5 Å²	122.5	63%	0.628	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-7.1	174.8	0	0	0	0	0	113.1	I122 S128	I122-A126 VanDerWaalsContact O-CB 3.26Å; I122-A126 WeakPolarHBondContact O-CB 3.35Å; I122-A126 PolarHBondContact O-N 2.94Å; A126-S128 VanDerWaalsContact C-N 3.29Å; A126-S128 PolarHBondContact O-N 3.36Å
127	G	55.1	Low	57.5	Low	65 Å²	65	123.4 Å²	123.4	67%	0.67	68%	0.679	S	S	*	*			trans	-78.8	64.6	179.1	0	0	0	0	0	113.7	R123 V124 M125	R123-G127 PolarHBondContact O-N 2.93Å; V124-G127 PolarHBondContact O-N 3.28Å; M125-G127 VanDerWaalsContact C-N 3.25Å; M125-G127 PolarHBondContact O-N 3.28Å
128	S	37.2	Very low	54.8	Low	103 Å²	103	122 Å²	122	72%	0.72	68%	0.68	S	S	*	*			trans	-136.9	131.4	169.8	-167.1	0	0	0	0	111	A126	A126-S128 VanDerWaalsContact C-N 3.29Å; A126-S128 PolarHBondContact O-N 3.36Å
129	P	52.4	Low	52.1	Low	117 Å²	117	129.3 Å²	129.3	76%	0.76	70%	0.699	S	S	*	*			trans	-94.8	112.3	-163.1	34	-33.6	0	0	0	114.1
130	N	31.8	Very low	49.2	Very low	170 Å²	170	130.6 Å²	130.6	91%	0.909	72%	0.717	S	S	*	*			trans	-173.3	165.2	131.8	-113.8	-39.2	0	0	0	117.2
131	S	30.7	Very low	46.9	Very low	116 Å²	116	133.1 Å²	133.1	81%	0.811	73%	0.73	S	S	*	*			trans	94.6	148.1	162.4	-149	0	0	0	0	118.7
132	R	38	Very low	44.6	Very low	229 Å²	229	135.5 Å²	135.5	86%	0.864	75%	0.749	S	S	*	*			trans	-130.1	139.1	-170.4	-64.5	170.3	166.7	-179.9	-6.1	110.8
133	Q	35.3	Very low	42.2	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	76%	0.763	S	S	*	*			trans	179.6	138.7	142.3	-97.5	152.8	-15.7	0	0	107.5
134	H	31.8	Very low	39.7	Very low	154 Å²	154	133.5 Å²	133.5	71%	0.713	76%	0.761	S	S	*	*				56	128	70.6	-91.8	-49	0	0	0	112.2	D136	H134-D136 IonicContact CE1-OD2 3.55Å; H134-D136 IonicContact CG-OD2 3.98Å; H134-D136 IonicContact ND1-OD2 2.83Å; H134-D136 PolarHBondContact ND1-OD2 3.2Å
135	C	27.5	Very low	37.7	Very low	115 Å²	115	139 Å²	139	78%	0.777	77%	0.77	S	S	*	*			cis	-144.2	-176.2	4.1	-53.4	0	0	0	0	111.8
136	D	29.9	Very low	36.3	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	77%	0.767	S	S	*	*				-169.8	149	-58.9	-77.4	-38.6	0	0	0	108.7	H134	H134-D136 IonicContact CE1-OD2 3.55Å; H134-D136 IonicContact CG-OD2 3.98Å; H134-D136 IonicContact ND1-OD2 2.83Å; H134-D136 PolarHBondContact ND1-OD2 3.2Å
137	G	30.3	Very low	35.1	Very low	75 Å²	75	142.8 Å²	142.8	77%	0.773	78%	0.775	S	S	*	*			trans	103.4	144	165.4	0	0	0	0	0	117.7
138	E	32.6	Very low	34.2	Very low	166 Å²	166	151.6 Å²	151.6	78%	0.776	79%	0.788	S	S	*	*			cis	-145.3	141.7	-4	-61.3	-172.3	117.8	0	0	111.9
139	R	33.8	Very low	34	Very low	230 Å²	230	154.1 Å²	154.1	87%	0.868	79%	0.788	S	S	*	*				169.4	158.2	109.4	-89.3	-179.3	-175.4	-154.2	-3.1	112.6
140	C	28.8	Very low	33.3	Very low	114 Å²	114	153 Å²	153	77%	0.77	78%	0.776	S	S	*	*			trans	-62.7	169	-175.9	-86.4	0	0	0	0	114.5
141	D	32.1	Very low	33.8	Very low	143 Å²	143	152.8 Å²	152.8	77%	0.765	77%	0.767	S	S	*	*			cis	-159.1	177.2	27.6	-141.4	-28.4	0	0	0	115.5
142	T	34.7	Very low	34.4	Very low	139 Å²	139	157.7 Å²	157.7	85%	0.853	77%	0.767	S	S	*	*			trans	87.5	150.6	166.3	-16.3	0	0	0	0	117.6
143	D	32.8	Very low	34.8	Very low	152 Å²	152	155 Å²	155	81%	0.813	76%	0.762	S	S	*	*			trans	-128.3	158.9	-141.8	-160.2	8.6	0	0	0	116.2
144	A	33.9	Very low	34.9	Very low	67 Å²	67	153.2 Å²	153.2	55%	0.554	75%	0.753	S	S	*	*			trans	47.8	116.7	148.4	0	0	0	0	0	123.9
145	R	32.7	Very low	35.3	Very low	225 Å²	225	155.5 Å²	155.5	85%	0.849	76%	0.756	S	S	*	*				106.6	139.3	121.8	-80.5	178.3	-172.4	-169.3	3.8	123.3
146	E	33.7	Very low	35.6	Very low	147 Å²	147	155.3 Å²	155.3	69%	0.687	75%	0.746	S	S	*	*			trans	61.4	95.3	150.4	-68.4	-171.4	96.7	0	0	122.5	R148	E146-R148 PolarHBondContact O-N 2.97Å
147	M	41.9	Very low	36.3	Very low	159 Å²	159	155.2 Å²	155.2	78%	0.783	75%	0.753	S	S	*	*				33	91.8	99.3	-174.3	-169.4	65.7	0	0	116.9
148	R	35.6	Very low	36.7	Very low	250 Å²	250	158 Å²	158	94%	0.943	75%	0.746	S	S	*	*			trans	-154.2	138.9	136.8	-130.4	171.3	-177	153.3	3	118	E146	E146-R148 PolarHBondContact O-N 2.97Å
149	E	34.1	Very low	36.7	Very low	155 Å²	155	159.3 Å²	159.3	72%	0.724	75%	0.752	S	S	*	*			trans	-65.2	153.2	177.4	-165.8	-162.9	156.7	0	0	115.8
150	N	37.5	Very low	36.8	Very low	95 Å²	95	155 Å²	155	51%	0.508	74%	0.742	S	S	.	*			trans	87.1	126.4	144.1	-94.7	-23.7	0	0	0	124.7
151	K	41.8	Very low	36.7	Very low	165 Å²	165	156 Å²	156	72%	0.717	74%	0.735	S	S	*	*			trans	65.3	129.9	135.3	-66.5	160.7	-178.1	148.1	0	120.6
152	R	44.3	Very low	36.8	Very low	218 Å²	218	156.5 Å²	156.5	82%	0.823	73%	0.732	S	S	*	*				-179.5	132	101.5	-98	158.4	179.6	174.2	1.7	115.8
153	K	46.2	Very low	36.8	Very low	172 Å²	172	155.9 Å²	155.9	75%	0.748	73%	0.734	S	S	*	*			trans	71.6	155.9	145.5	-64.1	166.2	167	-163.6	0	117.1
154	Q	36.4	Very low	37.3	Very low	146 Å²	146	154.3 Å²	154.3	68%	0.682	73%	0.729	S	S	*	*			cis	-153.5	134.1	-1.1	-133.8	159.3	-81.6	0	0	113.1
155	R	40.2	Very low	37.7	Very low	202 Å²	202	157.2 Å²	157.2	76%	0.762	73%	0.733	S	S	*	*			trans	38	150.3	134.1	-62.9	-166.9	172.9	-103.1	2.5	121.3
156	L	34.5	Very low	38.4	Very low	111 Å²	111	149.1 Å²	149.1	58%	0.581	72%	0.72	S	S	*	*			cis	-162.8	-163.5	-8	-135.8	76	0	0	0	106.1	Q158	L156-Q158 HydrophobicContact CD2-CB 4.42Å; L156-Q158 HydrophobicContact CG-CB 4.45Å
157	P	45	Very low	39	Very low	129 Å²	129	151.4 Å²	151.4	84%	0.838	72%	0.723	S	S	*	*			cis	-99.3	-177.7	7.2	40.5	-34.2	0	0	0	114.6
158	Q	37.5	Very low	39.6	Very low	132 Å²	132	146.3 Å²	146.3	62%	0.617	70%	0.701	S	S	*	*			trans	-138.9	140.2	-164.6	169.7	-173.6	-12.2	0	0	109.5	L156	L156-Q158 HydrophobicContact CD2-CB 4.42Å; L156-Q158 HydrophobicContact CG-CB 4.45Å
159	H	33.9	Very low	40.8	Very low	195 Å²	195	141.1 Å²	141.1	90%	0.903	69%	0.686	S	S	*	*			trans	-134.4	153.4	156.7	-138.8	40.9	0	0	0	110.3
160	Q	35.8	Very low	42.2	Very low	140 Å²	140	139.8 Å²	139.8	65%	0.654	68%	0.68	S	S	*	*			trans	-86.6	161.3	-172	-114.4	162.3	-101.7	0	0	110.1
161	E	26.4	Very low	43.9	Very low	133 Å²	133	141.4 Å²	141.4	62%	0.621	68%	0.684	S	S	*	*				-148.7	157.5	50.9	-79.6	-79.9	74.5	0	0	114
162	H	33.9	Very low	45.5	Very low	155 Å²	155	138.8 Å²	138.8	72%	0.718	67%	0.674	S	S	*	*			trans	31.2	107.3	156.1	-77	-81.2	0	0	0	122.1
163	S	35.8	Very low	46.9	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	66%	0.66	S	S	*	*			trans	-111.4	108.1	161.2	-70.8	0	0	0	0	111.6
164	T	42.6	Very low	48.8	Very low	118 Å²	118	128.8 Å²	128.8	72%	0.724	65%	0.647	S	S	*	*			trans	-140.7	23	175.7	-25.1	0	0	0	0	114.3
165	M	43	Very low	51.1	Low	128 Å²	128	129 Å²	129	63%	0.631	65%	0.645	S	S	*	*			trans	-132	40	-175.3	-72.2	-65.5	-70.3	0	0	113.3
166	G	46.8	Very low	53.4	Low	55 Å²	55	124.8 Å²	124.8	57%	0.567	64%	0.638	S	S	*	*	S	Bend	trans	-83	-60.2	177.2	0	0	0	0	0	113.1
167	Y	46.1	Very low	55.8	Low	195 Å²	195	126.2 Å²	126.2	77%	0.765	64%	0.639	S	S	*	*	H	α-helix	trans	-68.8	-41.4	-169.4	-58.3	-74.8	0	0	0	113.9	K169 E170 E171	Y167-K169 VanDerWaalsContact C-N 3.3Å; Y167-K169 PolarHBondContact O-N 3.08Å; Y167-E170 PolarHBondContact O-N 3.11Å; Y167-E170 VanDerWaalsContact O-N 3.07Å; Y167-E171 PolarHBondContact O-N 3.08Å; Y167-E171 VanDerWaalsContact O-N 3.13Å
168	T	53.9	Low	57.9	Low	52 Å²	52	126.7 Å²	126.7	32%	0.319	63%	0.63	S	S	.	*	H	α-helix	trans	-57.4	-39	-176.6	43.8	0	0	0	0	113.3	E170 E171 E172	T168-E170 PolarHBondContact O-N 3.32Å; T168-E171 PolarHBondContact O-N 3.05Å; T168-E172 WeakPolarHBondContact O-CB 3.34Å; T168-E172 VanDerWaalsContact O-CG 3.25Å; T168-E172 WeakPolarHBondContact O-CG 3.37Å; T168-E172 PolarHBondContact O-N 2.84Å
169	K	60.6	Low	60.4	Low	141 Å²	141	125.9 Å²	125.9	61%	0.613	63%	0.626	S	S	*	*	H	α-helix	trans	-70.1	-29.2	179	-75.5	-172.1	171.4	-174.7	0	113.7	Y167 C173	Y167-K169 VanDerWaalsContact C-N 3.3Å; Y167-K169 PolarHBondContact O-N 3.08Å; K169-C173 WeakPolarHBondContact O-CB 3.35Å; K169-C173 PolarHBondContact O-N 2.85Å
170	E	64.1	Low	63.1	Low	128 Å²	128	121.4 Å²	121.4	60%	0.598	61%	0.609	S	S	*	*	H	α-helix	trans	-78.8	-33.7	177.5	-170	160.1	-147.6	0	0	111.3	Y167 T168 H174	Y167-E170 PolarHBondContact O-N 3.11Å; Y167-E170 VanDerWaalsContact O-N 3.07Å; T168-E170 PolarHBondContact O-N 3.32Å; E170-H174 PolarHBondContact O-N 3.21Å; E170-H174 PolarHBondContact O-ND1 3.19Å
171	E	72.8	Confident	65.7	Low	129 Å²	129	119.6 Å²	119.6	60%	0.603	60%	0.6	S	S	*	*	H	α-helix	trans	-67	-46.1	169.7	-66.9	171.2	170.7	0	0	111.9	Y167 T168 C173 H174 K175	Y167-E171 PolarHBondContact O-N 3.08Å; Y167-E171 VanDerWaalsContact O-N 3.13Å; T168-E171 PolarHBondContact O-N 3.05Å; E171-C173 VanDerWaalsContact C-N 3.33Å; E171-C173 PolarHBondContact O-N 3.24Å; E171-H174 PolarHBondContact O-N 3.32Å; E171-K175 WeakPolarHBondContact O-CB 3.15Å; E171-K175 PolarHBondContact O-N 2.79Å
172	E	76.6	Confident	68.7	Low	109 Å²	109	116.9 Å²	116.9	51%	0.509	60%	0.596	S	S	.	*	H	α-helix	trans	-59.3	-42.5	173.3	-76	170.9	166.6	0	0	111.7	T168 K175 L176	T168-E172 WeakPolarHBondContact O-CB 3.34Å; T168-E172 VanDerWaalsContact O-CG 3.25Å; T168-E172 WeakPolarHBondContact O-CG 3.37Å; T168-E172 PolarHBondContact O-N 2.84Å; E172-K175 PolarHBondContact O-N 2.99Å; E172-L176 WeakPolarHBondContact O-CB 3.42Å; E172-L176 WeakPolarHBondContact O-CG 3.45Å; E172-L176 PolarHBondContact O-N 3.45Å
173	C	73.2	Confident	71.4	Confident	78 Å²	78	114.7 Å²	114.7	53%	0.527	59%	0.587	S	S	.	*	H	α-helix	trans	-62.9	-41.9	175.5	-173.5	0	0	0	0	112.1	K169 E171 K177	K169-C173 WeakPolarHBondContact O-CB 3.35Å; K169-C173 PolarHBondContact O-N 2.85Å; E171-C173 VanDerWaalsContact C-N 3.33Å; E171-C173 PolarHBondContact O-N 3.24Å; C173-K177 VanDerWaalsContact O-CB 3.25Å; C173-K177 WeakPolarHBondContact O-CB 3.26Å; C173-K177 PolarHBondContact O-N 3.04Å
174	H	85.4	Confident	73.9	Confident	102 Å²	102	112.7 Å²	112.7	47%	0.472	56%	0.564	S	S	.	*	H	α-helix	trans	-62.9	-46	173	-84	84.1	0	0	0	111.9	E170 E171 L176 K177 E178	E170-H174 PolarHBondContact O-N 3.21Å; E170-H174 PolarHBondContact O-ND1 3.19Å; E171-H174 PolarHBondContact O-N 3.32Å; H174-L176 PolarHBondContact O-N 2.99Å; H174-K177 WeakPolarHBondContact O-CB 3.4Å; H174-K177 PolarHBondContact O-N 3.29Å; H174-K177 VanDerWaalsContact O-N 3.12Å; H174-E178 WeakPolarHBondContact O-CG 3.41Å; H174-E178 PolarHBondContact O-N 2.99Å
175	K	86	Confident	76.2	Confident	150 Å²	150	113.9 Å²	113.9	65%	0.652	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-41.3	-179.7	-167.1	172.1	-176.1	177.2	0	112.6	E171 E172 E178 Q179	E171-K175 WeakPolarHBondContact O-CB 3.15Å; E171-K175 PolarHBondContact O-N 2.79Å; E172-K175 PolarHBondContact O-N 2.99Å; K175-E178 PolarHBondContact O-N 2.86Å; K175-Q179 WeakPolarHBondContact O-CB 3.44Å; K175-Q179 PolarHBondContact O-N 2.71Å
176	L	88.6	Confident	78.5	Confident	114 Å²	114	112.8 Å²	112.8	60%	0.597	55%	0.551	S	S	*	*	H	α-helix	trans	-66.5	-36.6	173.3	-72.8	170	0	0	0	112.2	E172 H174 Q179 L180	E172-L176 WeakPolarHBondContact O-CB 3.42Å; E172-L176 WeakPolarHBondContact O-CG 3.45Å; E172-L176 PolarHBondContact O-N 3.45Å; H174-L176 PolarHBondContact O-N 2.99Å; L176-Q179 PolarHBondContact O-N 3.44Å; L176-L180 WeakPolarHBondContact O-CB 3.46Å; L176-L180 PolarHBondContact O-N 2.93Å
177	K	83.5	Confident	80.6	Confident	141 Å²	141	114.8 Å²	114.8	61%	0.613	55%	0.548	S	S	*	.	H	α-helix	trans	-67.7	-38.5	175.7	-174.6	-178.5	179.5	-174.6	0	112.1	C173 H174 H181	C173-K177 VanDerWaalsContact O-CB 3.25Å; C173-K177 WeakPolarHBondContact O-CB 3.26Å; C173-K177 PolarHBondContact O-N 3.04Å; H174-K177 WeakPolarHBondContact O-CB 3.4Å; H174-K177 PolarHBondContact O-N 3.29Å; H174-K177 VanDerWaalsContact O-N 3.12Å; K177-H181 WeakPolarHBondContact O-CB 3.18Å; K177-H181 PolarHBondContact O-N 2.82Å
178	E	89.9	Confident	82.6	Confident	139 Å²	139	112.5 Å²	112.5	65%	0.65	54%	0.538	S	S	*	.	H	α-helix	trans	-66.1	-44.6	171.3	-72.2	-173.2	150.7	0	0	111.9	H174 K175 L180 H181 S182	H174-E178 WeakPolarHBondContact O-CG 3.41Å; H174-E178 PolarHBondContact O-N 2.99Å; K175-E178 PolarHBondContact O-N 2.86Å; E178-L180 PolarHBondContact O-N 3.42Å; E178-H181 PolarHBondContact O-N 3.43Å; E178-S182 WeakPolarHBondContact O-CB 3.29Å; E178-S182 PolarHBondContact O-N 3.33Å
179	Q	88.8	Confident	84.2	Confident	115 Å²	115	115 Å²	115	54%	0.537	55%	0.546	S	S	.	.	H	α-helix	trans	-60.2	-43.8	175.8	-176.6	176	-20.9	0	0	111.8	K175 L176 S182 M183	K175-Q179 WeakPolarHBondContact O-CB 3.44Å; K175-Q179 PolarHBondContact O-N 2.71Å; L176-Q179 PolarHBondContact O-N 3.44Å; Q179-S182 WeakPolarHBondContact O-CB 3.48Å; Q179-S182 PolarHBondContact O-N 3.44Å; Q179-M183 PolarHBondContact O-N 2.94Å
180	L	90.4	Very high	85.6	Confident	102 Å²	102	112.8 Å²	112.8	53%	0.534	54%	0.541	S	S	.	.	H	α-helix	trans	-61.4	-44.6	174.2	179.5	62.9	0	0	0	111.7	L176 E178 S182 M183 Q184	L176-L180 WeakPolarHBondContact O-CB 3.46Å; L176-L180 PolarHBondContact O-N 2.93Å; E178-L180 PolarHBondContact O-N 3.42Å; L180-S182 VanDerWaalsContact C-N 3.31Å; L180-S182 PolarHBondContact O-N 3.35Å; L180-M183 PolarHBondContact O-N 3.35Å; L180-Q184 WeakPolarHBondContact O-CB 3.43Å; L180-Q184 VanDerWaalsContact O-CG 3.32Å; L180-Q184 WeakPolarHBondContact O-CG 3.27Å; L180-Q184 PolarHBondContact O-N 3.48Å
181	H	90.3	Very high	86.5	Confident	101 Å²	101	112.6 Å²	112.6	47%	0.468	54%	0.54	S	S	.	.	H	α-helix	trans	-66.3	-33.7	177.9	-172.7	-149.6	0	0	0	112.3	K177 E178 R185	K177-H181 WeakPolarHBondContact O-CB 3.18Å; K177-H181 PolarHBondContact O-N 2.82Å; E178-H181 PolarHBondContact O-N 3.43Å; H181-R185 PolarHBondContact O-N 2.87Å; H181-R185 VanDerWaalsContact O-N 3.1Å
182	S	91.2	Very high	87	Confident	76 Å²	76	112.7 Å²	112.7	53%	0.531	54%	0.54	S	S	.	.	H	α-helix	trans	-65.1	-49.5	172	-171.3	0	0	0	0	111.4	E178 Q179 L180 Q184 R185 L186	E178-S182 WeakPolarHBondContact O-CB 3.29Å; E178-S182 PolarHBondContact O-N 3.33Å; Q179-S182 WeakPolarHBondContact O-CB 3.48Å; Q179-S182 PolarHBondContact O-N 3.44Å; L180-S182 VanDerWaalsContact C-N 3.31Å; L180-S182 PolarHBondContact O-N 3.35Å; S182-Q184 VanDerWaalsContact C-N 3.32Å; S182-Q184 PolarHBondContact O-N 2.64Å; S182-R185 WeakPolarHBondContact O-CA 3.33Å; S182-R185 WeakPolarHBondContact O-CB 3.35Å; S182-R185 PolarHBondContact O-N 3.3Å; S182-L186 PolarHBondContact O-N 3.39Å
183	M	90.8	Very high	87.1	Confident	110 Å²	110	113.4 Å²	113.4	54%	0.542	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-37.3	175.8	-70.2	-162	76.4	0	0	112.7	Q179 L180 R185 L186 L187	Q179-M183 PolarHBondContact O-N 2.94Å; L180-M183 PolarHBondContact O-N 3.35Å; M183-R185 PolarHBondContact O-N 3.01Å; M183-L186 PolarHBondContact O-N 3.49Å; M183-L187 WeakPolarHBondContact O-CB 3.42Å; M183-L187 WeakPolarHBondContact O-CG 3.49Å; M183-L187 PolarHBondContact O-N 2.78Å
184	Q	87.1	Confident	87.5	Confident	83 Å²	83	116.2 Å²	116.2	39%	0.388	55%	0.545	S	S	.	.	H	α-helix	trans	-68.5	-18.6	173.2	-73.6	-179.8	8.1	0	0	114.1	L180 S182 R188	L180-Q184 WeakPolarHBondContact O-CB 3.43Å; L180-Q184 VanDerWaalsContact O-CG 3.32Å; L180-Q184 WeakPolarHBondContact O-CG 3.27Å; L180-Q184 PolarHBondContact O-N 3.48Å; S182-Q184 VanDerWaalsContact C-N 3.32Å; S182-Q184 PolarHBondContact O-N 2.64Å; Q184-R188 PolarHBondContact O-NE 2.85Å; Q184-R188 VanDerWaalsContact O-NE 3.1Å
185	R	90.6	Very high	87.1	Confident	144 Å²	144	117.1 Å²	117.1	54%	0.543	55%	0.553	S	S	.	*	H	α-helix	trans	-84.4	-43.8	171.7	-167.6	179	-57.7	171.6	5.5	110.6	H181 S182 M183 R188 Q189	H181-R185 PolarHBondContact O-N 2.87Å; H181-R185 VanDerWaalsContact O-N 3.1Å; S182-R185 WeakPolarHBondContact O-CA 3.33Å; S182-R185 WeakPolarHBondContact O-CB 3.35Å; S182-R185 PolarHBondContact O-N 3.3Å; M183-R185 PolarHBondContact O-N 3.01Å; R185-R188 WeakPolarHBondContact O-CB 3.38Å; R185-R188 PolarHBondContact O-N 3.46Å; R185-R188 VanDerWaalsContact O-N 3.15Å; R185-Q189 WeakPolarHBondContact O-CG 3.37Å; R185-Q189 PolarHBondContact O-N 3.16Å
186	L	92	Very high	86.4	Confident	105 Å²	105	114.7 Å²	114.7	55%	0.55	54%	0.544	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.7	-166.9	72.2	0	0	0	111.8	S182 M183 R188 Q189 L190	S182-L186 PolarHBondContact O-N 3.39Å; M183-L186 PolarHBondContact O-N 3.49Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 3.21Å; L186-Q189 PolarHBondContact O-N 2.84Å; L186-L190 WeakPolarHBondContact O-CB 3.45Å; L186-L190 PolarHBondContact O-N 3.3Å
187	L	89.8	Confident	85.5	Confident	96 Å²	96	113.2 Å²	113.2	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-60.5	-39.4	172.4	-83.2	165.3	0	0	0	112.2	M183 L190 Q191	M183-L187 WeakPolarHBondContact O-CB 3.42Å; M183-L187 WeakPolarHBondContact O-CG 3.49Å; M183-L187 PolarHBondContact O-N 2.78Å; L187-L190 PolarHBondContact O-N 2.93Å; L187-Q191 WeakPolarHBondContact O-CB 3.41Å; L187-Q191 VanDerWaalsContact O-CG 3.26Å; L187-Q191 WeakPolarHBondContact O-CG 3.24Å; L187-Q191 PolarHBondContact O-N 3.33Å
188	R	89.3	Confident	84.5	Confident	148 Å²	148	114.5 Å²	114.5	56%	0.558	54%	0.542	S	S	*	.	H	α-helix	trans	-67.5	-42.5	174.9	-99.9	177.1	-87.3	-137.4	-2.4	112.3	Q184 R185 L186 L190 Q191 E192	Q184-R188 PolarHBondContact O-NE 2.85Å; Q184-R188 VanDerWaalsContact O-NE 3.1Å; R185-R188 WeakPolarHBondContact O-CB 3.38Å; R185-R188 PolarHBondContact O-N 3.46Å; R185-R188 VanDerWaalsContact O-N 3.15Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 3.21Å; R188-L190 VanDerWaalsContact C-N 3.29Å; R188-L190 PolarHBondContact O-N 2.69Å; R188-Q191 PolarHBondContact O-N 3.43Å; R188-E192 WeakPolarHBondContact O-CB 3.29Å; R188-E192 PolarHBondContact O-N 2.99Å
189	Q	87.6	Confident	83	Confident	103 Å²	103	110.6 Å²	110.6	48%	0.481	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-35	173.7	-72.3	178.6	-49.1	0	0	112.1	R185 L186 K193	R185-Q189 WeakPolarHBondContact O-CG 3.37Å; R185-Q189 PolarHBondContact O-N 3.16Å; L186-Q189 PolarHBondContact O-N 2.84Å; Q189-K193 WeakPolarHBondContact O-CB 3.48Å; Q189-K193 VanDerWaalsContact O-CG 3.26Å; Q189-K193 WeakPolarHBondContact O-CG 3.31Å; Q189-K193 PolarHBondContact O-N 2.88Å
190	L	90.4	Very high	81.4	Confident	95 Å²	95	110 Å²	110	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-69.7	-43.2	174.6	-173.2	63.6	0	0	0	111.6	L186 L187 R188 K193 F194	L186-L190 WeakPolarHBondContact O-CB 3.45Å; L186-L190 PolarHBondContact O-N 3.3Å; L187-L190 PolarHBondContact O-N 2.93Å; R188-L190 VanDerWaalsContact C-N 3.29Å; R188-L190 PolarHBondContact O-N 2.69Å; L190-K193 PolarHBondContact O-N 3.44Å; L190-F194 HydrophobicContact CD1-CD2 4.24Å; L190-F194 HydrophobicContact CD1-CE2 4.01Å; L190-F194 HydrophobicContact CG-CD2 4.09Å; L190-F194 HydrophobicContact CG-CE2 4.05Å; L190-F194 WeakPolarHBondContact O-CD2 3.39Å; L190-F194 PolarHBondContact O-N 3.16Å
191	Q	83.2	Confident	79.6	Confident	125 Å²	125	111 Å²	111	58%	0.584	53%	0.529	S	S	*	.	H	α-helix	trans	-62.7	-42.5	173.7	-74.9	170.8	-26.5	0	0	112	L187 R188 K193 F194 L195	L187-Q191 WeakPolarHBondContact O-CB 3.41Å; L187-Q191 VanDerWaalsContact O-CG 3.26Å; L187-Q191 WeakPolarHBondContact O-CG 3.24Å; L187-Q191 PolarHBondContact O-N 3.33Å; R188-Q191 PolarHBondContact O-N 3.43Å; Q191-K193 VanDerWaalsContact C-N 3.31Å; Q191-K193 PolarHBondContact O-N 2.85Å; Q191-F194 PolarHBondContact O-N 2.85Å; Q191-L195 WeakPolarHBondContact O-CB 3.18Å; Q191-L195 PolarHBondContact O-N 3.36Å
192	E	82.5	Confident	77.7	Confident	130 Å²	130	111.9 Å²	111.9	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-63.4	-36.2	173.5	-175.7	173.3	-148.9	0	0	111.4	R188 L195 Q196	R188-E192 WeakPolarHBondContact O-CB 3.29Å; R188-E192 PolarHBondContact O-N 2.99Å; E192-L195 PolarHBondContact O-N 3.19Å; E192-Q196 WeakPolarHBondContact O-CB 3.08Å; E192-Q196 PolarHBondContact O-N 2.83Å
193	K	79.6	Confident	75.8	Confident	125 Å²	125	110.5 Å²	110.5	54%	0.543	53%	0.53	S	S	.	.	H	α-helix	trans	-69.9	-41.3	172.7	-78.7	-72.6	170.9	-166.3	0	113.5	Q189 L190 Q191 L195 Q196 V197	Q189-K193 WeakPolarHBondContact O-CB 3.48Å; Q189-K193 VanDerWaalsContact O-CG 3.26Å; Q189-K193 WeakPolarHBondContact O-CG 3.31Å; Q189-K193 PolarHBondContact O-N 2.88Å; L190-K193 PolarHBondContact O-N 3.44Å; Q191-K193 VanDerWaalsContact C-N 3.31Å; Q191-K193 PolarHBondContact O-N 2.85Å; K193-L195 VanDerWaalsContact C-N 3.34Å; K193-Q196 PolarHBondContact O-N 3.03Å; K193-V197 WeakPolarHBondContact O-CG2 3.18Å; K193-V197 PolarHBondContact O-N 3.24Å
194	F	79.9	Confident	73.9	Confident	137 Å²	137	111.5 Å²	111.5	60%	0.601	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-42.1	171.5	-89.8	-74.5	0	0	0	111.8	L190 Q191 Q196 V197 Y198	L190-F194 HydrophobicContact CD1-CD2 4.24Å; L190-F194 HydrophobicContact CD1-CE2 4.01Å; L190-F194 HydrophobicContact CG-CD2 4.09Å; L190-F194 HydrophobicContact CG-CE2 4.05Å; L190-F194 WeakPolarHBondContact O-CD2 3.39Å; L190-F194 PolarHBondContact O-N 3.16Å; Q191-F194 PolarHBondContact O-N 2.85Å; F194-Q196 VanDerWaalsContact C-N 3.32Å; F194-V197 PolarHBondContact O-N 3.44Å; F194-Y198 PolarHBondContact O-N 3.28Å
195	L	77.6	Confident	72.1	Confident	121 Å²	121	115.7 Å²	115.7	63%	0.634	55%	0.551	S	S	*	*	H	α-helix	trans	-67.5	-32.5	175	-172.6	62.7	0	0	0	112.1	Q191 E192 K193 Y198 S199	Q191-L195 WeakPolarHBondContact O-CB 3.18Å; Q191-L195 PolarHBondContact O-N 3.36Å; E192-L195 PolarHBondContact O-N 3.19Å; K193-L195 VanDerWaalsContact C-N 3.34Å; L195-Y198 PolarHBondContact O-N 3.27Å; L195-S199 WeakPolarHBondContact O-CB 3.38Å; L195-S199 PolarHBondContact O-N 2.83Å; L195-S199 PolarHBondContact O-OG 3.08Å
196	Q	71.1	Confident	70.1	Confident	98 Å²	98	113.9 Å²	113.9	46%	0.458	56%	0.556	S	S	.	*	H	α-helix	trans	-71.3	-33.6	174.9	-176.6	162.4	61.9	0	0	112.4	E192 K193 F194 S199 Q200	E192-Q196 WeakPolarHBondContact O-CB 3.08Å; E192-Q196 PolarHBondContact O-N 2.83Å; K193-Q196 PolarHBondContact O-N 3.03Å; F194-Q196 VanDerWaalsContact C-N 3.32Å; Q196-S199 WeakPolarHBondContact CA-OG 3.49Å; Q196-Q200 WeakPolarHBondContact O-CB 3.21Å; Q196-Q200 PolarHBondContact O-N 3.32Å
197	V	70.8	Confident	68	Low	83 Å²	83	114.5 Å²	114.5	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-63.8	-52.2	168.2	172.6	0	0	0	0	109.8	K193 F194 S199 Q200 E201	K193-V197 WeakPolarHBondContact O-CG2 3.18Å; K193-V197 PolarHBondContact O-N 3.24Å; F194-V197 PolarHBondContact O-N 3.44Å; V197-S199 PolarHBondContact O-N 3.16Å; V197-S199 VanDerWaalsContact O-N 3.15Å; V197-Q200 WeakPolarHBondContact O-CB 3.38Å; V197-Q200 PolarHBondContact O-N 2.95Å; V197-Q200 VanDerWaalsContact O-N 3.09Å; V197-E201 PolarHBondContact O-N 3.19Å
198	Y	62.5	Low	66	Low	168 Å²	168	120.1 Å²	120.1	66%	0.659	58%	0.578	S	S	*	*	H	α-helix	trans	-58.7	-28.5	178.3	-112	-74.5	0	0	0	114.6	F194 L195	F194-Y198 PolarHBondContact O-N 3.28Å; L195-Y198 PolarHBondContact O-N 3.27Å
199	S	58.6	Low	63.9	Low	57 Å²	57	121.8 Å²	121.8	40%	0.399	59%	0.592	S	S	.	*	H	α-helix	trans	-98	-11	177.7	51.7	0	0	0	0	114.2	L195 Q196 V197 E201 A203	L195-S199 WeakPolarHBondContact O-CB 3.38Å; L195-S199 PolarHBondContact O-N 2.83Å; L195-S199 PolarHBondContact O-OG 3.08Å; Q196-S199 WeakPolarHBondContact CA-OG 3.49Å; V197-S199 PolarHBondContact O-N 3.16Å; V197-S199 VanDerWaalsContact O-N 3.15Å; S199-E201 VanDerWaalsContact C-N 3.31Å; S199-A203 WeakPolarHBondContact O-CB 3.41Å; S199-A203 PolarHBondContact O-N 3.36Å
200	Q	54.9	Low	62	Low	102 Å²	102	121.5 Å²	121.5	48%	0.477	61%	0.607	S	S	.	*	H	α-helix	trans	-65.6	-41.3	163.5	-174	74.7	31.7	0	0	109.6	Q196 V197 D202 A203 E204	Q196-Q200 WeakPolarHBondContact O-CB 3.21Å; Q196-Q200 PolarHBondContact O-N 3.32Å; V197-Q200 WeakPolarHBondContact O-CB 3.38Å; V197-Q200 PolarHBondContact O-N 2.95Å; V197-Q200 VanDerWaalsContact O-N 3.09Å; Q200-D202 PolarHBondContact O-N 2.91Å; Q200-A203 PolarHBondContact O-N 2.79Å; Q200-E204 PolarHBondContact NE2-OE1 3.34Å; Q200-E204 PolarHBondContact O-N 3.3Å
201	E	51.6	Low	59.6	Low	123 Å²	123	121 Å²	121	58%	0.575	62%	0.617	S	S	*	*	H	α-helix	trans	-58.8	-43	177.6	-67.6	165	-160.6	0	0	112.1	V197 S199	V197-E201 PolarHBondContact O-N 3.19Å; S199-E201 VanDerWaalsContact C-N 3.31Å
202	D	50.9	Low	57.3	Low	120 Å²	120	118.8 Å²	118.8	64%	0.642	63%	0.628	S	S	*	*	H	α-helix	trans	-73	-39.2	172.7	-83.9	-30.2	0	0	0	113.2	Q200 E204 F205	Q200-D202 PolarHBondContact O-N 2.91Å; D202-E204 PolarHBondContact O-N 3.41Å; D202-F205 WeakPolarHBondContact O-CB 3.42Å; D202-F205 PolarHBondContact O-N 3.28Å; D202-F205 VanDerWaalsContact O-N 3.17Å
203	A	51.7	Low	55.5	Low	48 Å²	48	117.5 Å²	117.5	40%	0.397	64%	0.64	S	S	.	*	H	α-helix	trans	-66.9	-33.7	-172.6	0	0	0	0	0	113.4	S199 Q200 F205 V206 V207	S199-A203 WeakPolarHBondContact O-CB 3.41Å; S199-A203 PolarHBondContact O-N 3.36Å; Q200-A203 PolarHBondContact O-N 2.79Å; A203-F205 PolarHBondContact O-N 3.01Å; A203-V206 PolarHBondContact O-N 2.67Å; A203-V207 PolarHBondContact O-N 3.09Å
204	E	49.9	Very low	53.5	Low	130 Å²	130	118.5 Å²	118.5	61%	0.607	66%	0.656	S	S	*	*	H	α-helix	trans	-70.9	-17.3	177.1	-69.8	-174.5	-158.2	0	0	113.1	Q200 D202	Q200-E204 PolarHBondContact NE2-OE1 3.34Å; Q200-E204 PolarHBondContact O-N 3.3Å; D202-E204 PolarHBondContact O-N 3.41Å
205	F	49.3	Very low	51.7	Low	172 Å²	172	116.4 Å²	116.4	75%	0.754	66%	0.658	S	S	*	*	H	α-helix	trans	-75.6	-45.6	172.1	-152.4	-93.1	0	0	0	111.7	D202 A203 V207 R208	D202-F205 WeakPolarHBondContact O-CB 3.42Å; D202-F205 PolarHBondContact O-N 3.28Å; D202-F205 VanDerWaalsContact O-N 3.17Å; A203-F205 PolarHBondContact O-N 3.01Å; F205-V207 PolarHBondContact O-N 3.41Å; F205-R208 PolarHBondContact O-N 3.17Å
206	V	48.9	Very low	49.8	Very low	106 Å²	106	119.1 Å²	119.1	64%	0.642	67%	0.668	S	S	*	*	H	α-helix	trans	-72.4	-31.6	-172.2	-178.1	0	0	0	0	113.1	A203 R208	A203-V206 PolarHBondContact O-N 2.67Å; V206-R208 PolarHBondContact O-N 3.46Å
207	V	48.7	Very low	48.4	Very low	118 Å²	118	122.1 Å²	122.1	72%	0.715	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-68.9	-22.7	-179.7	176.1	0	0	0	0	112.5	A203 F205	A203-V207 PolarHBondContact O-N 3.09Å; F205-V207 PolarHBondContact O-N 3.41Å
208	R	46.4	Very low	47.1	Very low	214 Å²	214	124.3 Å²	124.3	81%	0.808	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-82.2	-19.2	-175.1	-167.6	169.8	-71.5	-109.6	2.4	114.2	F205 V206 A210	F205-R208 PolarHBondContact O-N 3.17Å; V206-R208 PolarHBondContact O-N 3.46Å; R208-A210 VanDerWaalsContact C-N 3.32Å; R208-A210 PolarHBondContact O-N 3.41Å
209	E	46.3	Very low	46.5	Very low	182 Å²	182	123.9 Å²	123.9	85%	0.85	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-78.2	-13.4	-174.2	-151.7	176.1	-150.2	0	0	113.9
210	A	47.1	Very low	46	Very low	97 Å²	97	129 Å²	129	80%	0.802	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-86.3	-2.1	-175	0	0	0	0	0	115.5	R208	R208-A210 VanDerWaalsContact C-N 3.32Å; R208-A210 PolarHBondContact O-N 3.41Å
211	A	41	Very low	45.5	Very low	84 Å²	84	127.1 Å²	127.1	69%	0.694	73%	0.727	S	S	*	*	S	Bend	trans	-131.9	88	-165.3	0	0	0	0	0	114.9
212	G	33.1	Very low	45.2	Very low	80 Å²	80	127.6 Å²	127.6	83%	0.825	73%	0.734	S	S	*	*			trans	57.9	100.4	145.3	0	0	0	0	0	119
213	A	45.7	Very low	45.2	Very low	103 Å²	103	124.6 Å²	124.6	85%	0.851	72%	0.722	S	S	*	*			trans	-71.1	134.8	175	0	0	0	0	0	114.4
214	V	36.7	Very low	45.4	Very low	145 Å²	145	127.2 Å²	127.2	88%	0.879	73%	0.734	S	S	*	*			trans	-139.4	161.1	147.1	179.5	0	0	0	0	107.6
215	S	42.2	Very low	45.6	Very low	93 Å²	93	126 Å²	126	65%	0.65	73%	0.731	S	S	*	*			trans	-72.9	154.4	-161.6	49.8	0	0	0	0	118.9
216	E	38.9	Very low	45.9	Very low	179 Å²	179	125.9 Å²	125.9	84%	0.836	73%	0.726	S	S	*	*			trans	85.9	118.5	142	-80.5	169.1	-176.4	0	0	123.3
217	H	40.4	Very low	46.3	Very low	160 Å²	160	126.7 Å²	126.7	74%	0.741	72%	0.723	S	S	*	*			trans	71.7	92.8	142.9	-107.3	-67.1	0	0	0	123
218	D	44.5	Very low	46.8	Very low	130 Å²	130	123.9 Å²	123.9	70%	0.695	71%	0.708	S	S	*	*				64.1	165.8	128.7	-76.6	-10.2	0	0	0	124
219	I	50.2	Low	47.6	Very low	159 Å²	159	118.2 Å²	118.2	82%	0.815	69%	0.691	S	S	*	*			trans	81.7	147.6	173.9	-45.5	-178.3	0	0	0	113.4
220	I	48.3	Very low	49	Very low	163 Å²	163	113.6 Å²	113.6	84%	0.836	67%	0.672	S	S	*	*	S	Bend	trans	69.8	46.8	-176.7	-31.6	-179.9	0	0	0	114.9
221	G	44.6	Very low	50.5	Low	64 Å²	64	114.1 Å²	114.1	66%	0.66	66%	0.66	S	S	*	*	S	Bend	trans	-132.4	-10.2	165.1	0	0	0	0	0	115.8
222	N	43.8	Very low	52.3	Low	132 Å²	132	116.7 Å²	116.7	71%	0.706	66%	0.658	S	S	*	*	S	Bend	trans	-124.1	15.8	-164.2	-90.4	73.2	0	0	0	115	R226	N222-R226 WeakPolarHBondContact O-CB 3.4Å
223	S	51.9	Low	54.7	Low	58 Å²	58	118.2 Å²	118.2	41%	0.406	64%	0.644	S	S	.	*	S	Bend	trans	-79.6	-63.1	-180	46.7	0	0	0	0	112.5	D225 R226 E227	S223-D225 PolarHBondContact O-N 2.86Å; S223-R226 CarbonylContact O-C 3.56Å; S223-R226 WeakPolarHBondContact O-CA 3.34Å; S223-R226 PolarHBondContact O-N 2.9Å; S223-E227 WeakPolarHBondContact O-CG 3.48Å; S223-E227 PolarHBondContact O-N 3.49Å
224	T	55	Low	56.6	Low	103 Å²	103	117 Å²	117	63%	0.632	63%	0.626	S	S	*	*	H	α-helix	trans	-60	-44.3	-171.5	39.2	0	0	0	0	113.8	R226 E227 S228	T224-R226 PolarHBondContact O-N 3.08Å; T224-E227 PolarHBondContact O-N 3.04Å; T224-S228 PolarHBondContact O-N 2.8Å; T224-S228 PolarHBondContact O-OG 3.36Å
225	D	53.7	Low	58.8	Low	105 Å²	105	115 Å²	115	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-74.1	-17	178.7	-162	36.9	0	0	0	113	S223 S228 Q229	S223-D225 PolarHBondContact O-N 2.86Å; D225-S228 WeakPolarHBondContact CA-OG 3.24Å; D225-S228 PolarHBondContact O-OG 3.18Å; D225-Q229 WeakPolarHBondContact O-CG 3.37Å; D225-Q229 PolarHBondContact O-NE2 2.8Å; D225-Q229 VanDerWaalsContact O-NE2 3.15Å; D225-Q229 PolarHBondContact OD2-NE2 3Å
226	R	57.1	Low	61	Low	169 Å²	169	118.1 Å²	118.1	64%	0.638	61%	0.612	S	S	*	*	H	α-helix	trans	-86.8	-31.5	170.3	-159.9	175.2	75.6	171.1	4.7	111.6	N222 S223 T224 N230	N222-R226 WeakPolarHBondContact O-CB 3.4Å; S223-R226 CarbonylContact O-C 3.56Å; S223-R226 WeakPolarHBondContact O-CA 3.34Å; S223-R226 PolarHBondContact O-N 2.9Å; T224-R226 PolarHBondContact O-N 3.08Å; R226-N230 WeakPolarHBondContact O-CB 3.38Å; R226-N230 PolarHBondContact O-N 3.07Å; R226-N230 PolarHBondContact O-ND2 3Å
227	E	56.9	Low	63.4	Low	123 Å²	123	115.8 Å²	115.8	58%	0.575	60%	0.601	S	S	*	*	H	α-helix	trans	-70.1	-40.1	174.8	-75.6	162.5	-166.5	0	0	111.8	S223 T224 N230 L231	S223-E227 WeakPolarHBondContact O-CG 3.48Å; S223-E227 PolarHBondContact O-N 3.49Å; T224-E227 PolarHBondContact O-N 3.04Å; E227-N230 PolarHBondContact O-N 3.23Å; E227-L231 WeakPolarHBondContact O-CB 3.35Å; E227-L231 PolarHBondContact O-N 3.33Å
228	S	58.2	Low	65.8	Low	58 Å²	58	112.8 Å²	112.8	41%	0.406	59%	0.587	S	S	.	*	H	α-helix	trans	-59.3	-46.7	172.7	65.7	0	0	0	0	111.7	T224 D225 L231 Q232	T224-S228 PolarHBondContact O-N 2.8Å; T224-S228 PolarHBondContact O-OG 3.36Å; D225-S228 WeakPolarHBondContact CA-OG 3.24Å; D225-S228 PolarHBondContact O-OG 3.18Å; S228-L231 PolarHBondContact O-N 3.32Å; S228-Q232 PolarHBondContact O-N 2.9Å
229	Q	64.8	Low	67.8	Low	95 Å²	95	112.2 Å²	112.2	44%	0.444	58%	0.583	S	S	.	*	H	α-helix	trans	-66.6	-44	177.9	-68.4	172	29.2	0	0	111.7	D225 L231 Q232 E233	D225-Q229 WeakPolarHBondContact O-CG 3.37Å; D225-Q229 PolarHBondContact O-NE2 2.8Å; D225-Q229 VanDerWaalsContact O-NE2 3.15Å; D225-Q229 PolarHBondContact OD2-NE2 3Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-L231 PolarHBondContact O-N 3.28Å; Q229-Q232 PolarHBondContact O-N 3.47Å; Q229-E233 WeakPolarHBondContact O-CG 3.44Å; Q229-E233 PolarHBondContact O-N 3.13Å
230	N	75.6	Confident	69.7	Low	85 Å²	85	107.8 Å²	107.8	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-38.3	175.3	-87.5	-92.4	0	0	0	112.3	R226 E227 E233 T234	R226-N230 WeakPolarHBondContact O-CB 3.38Å; R226-N230 PolarHBondContact O-N 3.07Å; R226-N230 PolarHBondContact O-ND2 3Å; E227-N230 PolarHBondContact O-N 3.23Å; N230-E233 PolarHBondContact O-N 2.91Å; N230-T234 VanDerWaalsContact O-CB 3.31Å; N230-T234 WeakPolarHBondContact O-CB 3.35Å; N230-T234 PolarHBondContact O-N 3.41Å; N230-T234 PolarHBondContact O-OG1 2.64Å
231	L	78.4	Confident	71.7	Confident	108 Å²	108	104.9 Å²	104.9	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-65.8	-43	174.8	-178.1	62	0	0	0	111.3	E227 S228 Q229 T234 L235	E227-L231 WeakPolarHBondContact O-CB 3.35Å; E227-L231 PolarHBondContact O-N 3.33Å; S228-L231 PolarHBondContact O-N 3.32Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-L231 PolarHBondContact O-N 3.28Å; L231-T234 PolarHBondContact O-N 2.94Å; L231-L235 HydrophobicContact CD1-CD1 4.29Å; L231-L235 HydrophobicContact CD1-CG 4.36Å; L231-L235 HydrophobicContact CG-CD1 4.09Å; L231-L235 WeakPolarHBondContact O-CB 3.41Å; L231-L235 VanDerWaalsContact O-CG 3.29Å; L231-L235 WeakPolarHBondContact O-CG 3.5Å; L231-L235 PolarHBondContact O-N 2.88Å
232	Q	79	Confident	73.8	Confident	138 Å²	138	104.6 Å²	104.6	65%	0.645	54%	0.539	S	S	*	.	H	α-helix	trans	-61.8	-43	175.8	-174.4	179.8	4	0	0	112	S228 Q229 K236	S228-Q232 PolarHBondContact O-N 2.9Å; Q229-Q232 PolarHBondContact O-N 3.47Å; Q232-K236 VanDerWaalsContact O-CB 3.3Å; Q232-K236 WeakPolarHBondContact O-CB 3.45Å; Q232-K236 PolarHBondContact O-N 2.84Å
233	E	82.2	Confident	76	Confident	113 Å²	113	102 Å²	102	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-67.8	-41.2	176.4	-71.5	-169.6	165.9	0	0	112.2	Q229 N230 K236 Q237	Q229-E233 WeakPolarHBondContact O-CG 3.44Å; Q229-E233 PolarHBondContact O-N 3.13Å; N230-E233 PolarHBondContact O-N 2.91Å; E233-K236 PolarHBondContact O-N 3.23Å; E233-Q237 WeakPolarHBondContact O-CB 3.46Å; E233-Q237 VanDerWaalsContact O-CG 3.3Å; E233-Q237 WeakPolarHBondContact O-CG 3.2Å; E233-Q237 PolarHBondContact O-N 2.93Å
234	T	86.7	Confident	77.8	Confident	77 Å²	77	103.1 Å²	103.1	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-61.3	-46.8	175.7	-57.9	0	0	0	0	111.2	N230 L231 K236 Q237 E238	N230-T234 VanDerWaalsContact O-CB 3.31Å; N230-T234 WeakPolarHBondContact O-CB 3.35Å; N230-T234 PolarHBondContact O-N 3.41Å; N230-T234 PolarHBondContact O-OG1 2.64Å; L231-T234 PolarHBondContact O-N 2.94Å; T234-K236 VanDerWaalsContact C-N 3.33Å; T234-K236 PolarHBondContact O-N 3.01Å; T234-Q237 PolarHBondContact O-N 2.93Å; T234-E238 PolarHBondContact O-N 2.87Å
235	L	83.1	Confident	79.4	Confident	104 Å²	104	101.3 Å²	101.3	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-40.2	176	-74.2	169.7	0	0	0	112	L231 L239	L231-L235 HydrophobicContact CD1-CD1 4.29Å; L231-L235 HydrophobicContact CD1-CG 4.36Å; L231-L235 HydrophobicContact CG-CD1 4.09Å; L231-L235 WeakPolarHBondContact O-CB 3.41Å; L231-L235 VanDerWaalsContact O-CG 3.29Å; L231-L235 WeakPolarHBondContact O-CG 3.5Å; L231-L235 PolarHBondContact O-N 2.88Å; L235-L239 VanDerWaalsContact O-CB 3.3Å; L235-L239 WeakPolarHBondContact O-CB 3.27Å; L235-L239 PolarHBondContact O-N 3.45Å
236	K	88.1	Confident	81	Confident	158 Å²	158	100 Å²	100	69%	0.687	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-39.2	175.5	-178.3	-177	174.9	-171.8	0	112	Q232 E233 T234 S240	Q232-K236 VanDerWaalsContact O-CB 3.3Å; Q232-K236 WeakPolarHBondContact O-CB 3.45Å; Q232-K236 PolarHBondContact O-N 2.84Å; E233-K236 PolarHBondContact O-N 3.23Å; T234-K236 VanDerWaalsContact C-N 3.33Å; T234-K236 PolarHBondContact O-N 3.01Å; K236-S240 VanDerWaalsContact O-CB 3.29Å; K236-S240 WeakPolarHBondContact O-CB 3.3Å; K236-S240 PolarHBondContact O-N 2.92Å
237	Q	88.5	Confident	82.5	Confident	129 Å²	129	96.2 Å²	96.2	60%	0.603	51%	0.506	S	S	*	.	H	α-helix	trans	-68.4	-48.9	176.9	-73.1	177.5	34.7	0	0	111.7	E233 T234 L239 S240 K241	E233-Q237 WeakPolarHBondContact O-CB 3.46Å; E233-Q237 VanDerWaalsContact O-CG 3.3Å; E233-Q237 WeakPolarHBondContact O-CG 3.2Å; E233-Q237 PolarHBondContact O-N 2.93Å; T234-Q237 PolarHBondContact O-N 2.93Å; Q237-L239 PolarHBondContact O-N 3.24Å; Q237-S240 PolarHBondContact O-N 2.71Å; Q237-K241 VanDerWaalsContact O-CB 3.24Å; Q237-K241 WeakPolarHBondContact O-CB 3.31Å; Q237-K241 PolarHBondContact O-N 3.39Å
238	E	90.4	Very high	84	Confident	98 Å²	98	95.3 Å²	95.3	46%	0.458	51%	0.505	S	S	.	.	H	α-helix	trans	-67.6	-33.4	177.7	-75.6	-61.8	136.8	0	0	112.7	T234 K241 A242	T234-E238 PolarHBondContact O-N 2.87Å; E238-K241 IonicContact OE1-NZ 3.28Å; E238-K241 PolarHBondContact OE1-NZ 2.89Å; E238-K241 IonicContact OE2-NZ 2.66Å; E238-K241 PolarHBondContact OE2-NZ 3.27Å; E238-A242 WeakPolarHBondContact O-CB 3.19Å; E238-A242 PolarHBondContact O-N 3.02Å
239	L	87.8	Confident	85.5	Confident	118 Å²	118	100.6 Å²	100.6	62%	0.618	52%	0.516	S	S	*	.	H	α-helix	trans	-63.9	-47.4	170.1	-92.8	163.9	0	0	0	112.1	L235 Q237 K241 A242 V243	L235-L239 VanDerWaalsContact O-CB 3.3Å; L235-L239 WeakPolarHBondContact O-CB 3.27Å; L235-L239 PolarHBondContact O-N 3.45Å; Q237-L239 PolarHBondContact O-N 3.24Å; L239-K241 VanDerWaalsContact C-N 3.34Å; L239-K241 PolarHBondContact O-N 2.99Å; L239-A242 PolarHBondContact O-N 3.27Å; L239-V243 WeakPolarHBondContact O-CB 3.27Å; L239-V243 VanDerWaalsContact O-CG2 3.31Å; L239-V243 WeakPolarHBondContact O-CG2 3.48Å; L239-V243 PolarHBondContact O-N 3.48Å
240	S	90	Very high	86.4	Confident	66 Å²	66	100.2 Å²	100.2	46%	0.462	52%	0.519	S	S	.	.	H	α-helix	trans	-58.6	-47.5	177.1	-176.2	0	0	0	0	111.2	K236 Q237 V243 N244	K236-S240 VanDerWaalsContact O-CB 3.29Å; K236-S240 WeakPolarHBondContact O-CB 3.3Å; K236-S240 PolarHBondContact O-N 2.92Å; Q237-S240 PolarHBondContact O-N 2.71Å; S240-V243 PolarHBondContact O-N 3.15Å; S240-N244 VanDerWaalsContact O-CG 3.23Å; S240-N244 PolarHBondContact O-N 2.8Å; S240-N244 PolarHBondContact O-ND2 2.77Å
241	K	90.7	Very high	86.9	Confident	102 Å²	102	103 Å²	103	44%	0.443	53%	0.528	S	S	.	.	H	α-helix	trans	-60.7	-47.9	175.8	177.3	176.5	157.2	-133	0	112	Q237 E238 L239 V243 N244 D245	Q237-K241 VanDerWaalsContact O-CB 3.24Å; Q237-K241 WeakPolarHBondContact O-CB 3.31Å; Q237-K241 PolarHBondContact O-N 3.39Å; E238-K241 IonicContact OE1-NZ 3.28Å; E238-K241 PolarHBondContact OE1-NZ 2.89Å; E238-K241 IonicContact OE2-NZ 2.66Å; E238-K241 PolarHBondContact OE2-NZ 3.27Å; L239-K241 VanDerWaalsContact C-N 3.34Å; L239-K241 PolarHBondContact O-N 2.99Å; K241-V243 VanDerWaalsContact C-N 3.33Å; K241-V243 PolarHBondContact O-N 3.13Å; K241-N244 PolarHBondContact O-N 3.09Å; K241-D245 WeakPolarHBondContact O-CB 3.25Å; K241-D245 PolarHBondContact O-N 3.13Å
242	A	88	Confident	87.1	Confident	58 Å²	58	105.5 Å²	105.5	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-64.7	-33.7	178.2	0	0	0	0	0	113.3	E238 L239 C246	E238-A242 WeakPolarHBondContact O-CB 3.19Å; E238-A242 PolarHBondContact O-N 3.02Å; L239-A242 PolarHBondContact O-N 3.27Å; A242-C246 WeakPolarHBondContact O-CB 3.31Å; A242-C246 PolarHBondContact O-N 2.96Å
243	V	88.8	Confident	87.1	Confident	77 Å²	77	106.3 Å²	106.3	47%	0.467	54%	0.536	S	S	.	.	H	α-helix	trans	-67.9	-46.3	172.5	167.6	0	0	0	0	110.7	L239 S240 K241 C246 I247	L239-V243 WeakPolarHBondContact O-CB 3.27Å; L239-V243 VanDerWaalsContact O-CG2 3.31Å; L239-V243 WeakPolarHBondContact O-CG2 3.48Å; L239-V243 PolarHBondContact O-N 3.48Å; S240-V243 PolarHBondContact O-N 3.15Å; K241-V243 VanDerWaalsContact C-N 3.33Å; K241-V243 PolarHBondContact O-N 3.13Å; V243-C246 WeakPolarHBondContact O-CB 3.47Å; V243-C246 PolarHBondContact O-N 3.39Å; V243-C246 VanDerWaalsContact O-N 3.15Å; V243-I247 HydrophobicContact CG1-CD1 3.85Å; V243-I247 WeakPolarHBondContact O-CG1 3.3Å; V243-I247 PolarHBondContact O-N 3.13Å
244	N	90.9	Very high	86.6	Confident	81 Å²	81	104.9 Å²	104.9	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-63.3	-45.1	176.3	-66.5	-21.7	0	0	0	111.6	S240 K241 C246 I247 D248	S240-N244 VanDerWaalsContact O-CG 3.23Å; S240-N244 PolarHBondContact O-N 2.8Å; S240-N244 PolarHBondContact O-ND2 2.77Å; K241-N244 PolarHBondContact O-N 3.09Å; N244-C246 PolarHBondContact O-N 3.16Å; N244-I247 CarbonylContact O-C 3.59Å; N244-I247 PolarHBondContact O-N 3.33Å; N244-I247 VanDerWaalsContact O-N 3.11Å; N244-D248 WeakPolarHBondContact O-CB 3.35Å; N244-D248 PolarHBondContact O-N 3.28Å
245	D	87.9	Confident	85.9	Confident	65 Å²	65	104 Å²	104	35%	0.348	53%	0.532	S	S	.	.	H	α-helix	trans	-54.6	-38	171.9	-113.6	73.3	0	0	0	112	K241 R249	K241-D245 WeakPolarHBondContact O-CB 3.25Å; K241-D245 PolarHBondContact O-N 3.13Å; D245-R249 VanDerWaalsContact O-CB 3.3Å; D245-R249 WeakPolarHBondContact O-CB 3.46Å; D245-R249 WeakPolarHBondContact O-CD 3.3Å; D245-R249 WeakPolarHBondContact O-CG 3.08Å; D245-R249 PolarHBondContact O-N 2.81Å; D245-R249 PolarHBondContact O-NE 3.27Å; D245-R249 IonicContact OD2-CZ 3.21Å; D245-R249 IonicContact OD2-NE 2.87Å; D245-R249 PolarHBondContact OD2-NE 2.93Å; D245-R249 IonicContact OD2-NH2 2.67Å; D245-R249 PolarHBondContact OD2-NH2 2.98Å
246	C	88	Confident	84.8	Confident	77 Å²	77	103 Å²	103	52%	0.52	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-45.1	176.9	-167.1	0	0	0	0	111.6	A242 V243 N244 R249 V250	A242-C246 WeakPolarHBondContact O-CB 3.31Å; A242-C246 PolarHBondContact O-N 2.96Å; V243-C246 WeakPolarHBondContact O-CB 3.47Å; V243-C246 PolarHBondContact O-N 3.39Å; V243-C246 VanDerWaalsContact O-N 3.15Å; N244-C246 PolarHBondContact O-N 3.16Å; C246-R249 PolarHBondContact O-N 3.43Å; C246-V250 WeakPolarHBondContact O-CG2 3.3Å; C246-V250 PolarHBondContact O-N 3.07Å
247	I	88.8	Confident	83.3	Confident	91 Å²	91	99.8 Å²	99.8	47%	0.467	53%	0.531	S	S	.	.	H	α-helix	trans	-59.9	-48.5	175.3	-68	164.9	0	0	0	110.1	V243 N244 R249 V250 F251	V243-I247 HydrophobicContact CG1-CD1 3.85Å; V243-I247 WeakPolarHBondContact O-CG1 3.3Å; V243-I247 PolarHBondContact O-N 3.13Å; N244-I247 CarbonylContact O-C 3.59Å; N244-I247 PolarHBondContact O-N 3.33Å; N244-I247 VanDerWaalsContact O-N 3.11Å; I247-R249 PolarHBondContact O-N 3.02Å; I247-V250 CarbonylContact O-C 3.6Å; I247-V250 PolarHBondContact O-N 3.2Å; I247-V250 VanDerWaalsContact O-N 3.13Å; I247-F251 WeakPolarHBondContact O-CB 3.3Å; I247-F251 PolarHBondContact O-N 2.84Å
248	D	88.5	Confident	81.4	Confident	104 Å²	104	98.9 Å²	98.9	56%	0.556	53%	0.534	S	S	*	.	H	α-helix	trans	-64.1	-37.6	178.4	-76.5	-18.5	0	0	0	112.2	N244 F251 K252	N244-D248 WeakPolarHBondContact O-CB 3.35Å; N244-D248 PolarHBondContact O-N 3.28Å; D248-F251 PolarHBondContact O-N 2.85Å; D248-K252 WeakPolarHBondContact O-CB 3.48Å; D248-K252 PolarHBondContact O-N 3.21Å
249	R	88.8	Confident	79.2	Confident	169 Å²	169	100.6 Å²	100.6	64%	0.638	55%	0.546	S	S	*	.	H	α-helix	trans	-65.5	-38	172.9	-72.4	162.8	-159.9	-150.1	7.4	111.8	D245 C246 I247 K253	D245-R249 VanDerWaalsContact O-CB 3.3Å; D245-R249 WeakPolarHBondContact O-CB 3.46Å; D245-R249 WeakPolarHBondContact O-CD 3.3Å; D245-R249 WeakPolarHBondContact O-CG 3.08Å; D245-R249 PolarHBondContact O-N 2.81Å; D245-R249 PolarHBondContact O-NE 3.27Å; D245-R249 IonicContact OD2-CZ 3.21Å; D245-R249 IonicContact OD2-NE 2.87Å; D245-R249 PolarHBondContact OD2-NE 2.93Å; D245-R249 IonicContact OD2-NH2 2.67Å; D245-R249 PolarHBondContact OD2-NH2 2.98Å; C246-R249 PolarHBondContact O-N 3.43Å; I247-R249 PolarHBondContact O-N 3.02Å; R249-K253 WeakPolarHBondContact O-CB 3.46Å; R249-K253 PolarHBondContact O-N 3.43Å
250	V	83.8	Confident	77.3	Confident	86 Å²	86	103 Å²	103	52%	0.521	56%	0.557	S	S	.	*	H	α-helix	trans	-68.3	-48.4	174.1	169.9	0	0	0	0	110.6	C246 I247 K253 V254	C246-V250 WeakPolarHBondContact O-CG2 3.3Å; C246-V250 PolarHBondContact O-N 3.07Å; I247-V250 CarbonylContact O-C 3.6Å; I247-V250 PolarHBondContact O-N 3.2Å; I247-V250 VanDerWaalsContact O-N 3.13Å; V250-K253 WeakPolarHBondContact O-CB 3.4Å; V250-K253 PolarHBondContact O-N 3.06Å; V250-K253 VanDerWaalsContact O-N 3.17Å; V250-V254 WeakPolarHBondContact O-CG2 2.95Å; V250-V254 PolarHBondContact O-N 2.96Å
251	F	85.6	Confident	75.1	Confident	143 Å²	143	107.3 Å²	107.3	63%	0.627	57%	0.574	S	S	*	*	H	α-helix	trans	-63.2	-48.4	-178.6	-148.7	-84.8	0	0	0	110.9	I247 D248 K253 V254 S255	I247-F251 WeakPolarHBondContact O-CB 3.3Å; I247-F251 PolarHBondContact O-N 2.84Å; D248-F251 PolarHBondContact O-N 2.85Å; F251-K253 VanDerWaalsContact C-N 3.28Å; F251-K253 PolarHBondContact O-N 3.38Å; F251-V254 PolarHBondContact O-N 3.37Å; F251-V254 VanDerWaalsContact O-N 3.13Å; F251-S255 PolarHBondContact O-N 2.74Å; F251-S255 PolarHBondContact O-OG 3.26Å; F251-S255 VanDerWaalsContact O-OG 3.14Å
252	K	84.1	Confident	72.6	Confident	162 Å²	162	110.3 Å²	110.3	70%	0.704	59%	0.593	S	S	*	*	H	α-helix	trans	-59	-37.7	173.7	-174.4	169.5	-175.9	170.5	0	112.2	D248 S256	D248-K252 WeakPolarHBondContact O-CB 3.48Å; D248-K252 PolarHBondContact O-N 3.21Å; K252-S256 VanDerWaalsContact O-CB 3.26Å; K252-S256 WeakPolarHBondContact O-CB 3.41Å; K252-S256 PolarHBondContact O-N 2.76Å; K252-S256 PolarHBondContact O-OG 2.76Å
253	K	77.8	Confident	69.9	Low	155 Å²	155	112.6 Å²	112.6	67%	0.674	61%	0.606	S	S	*	*	H	α-helix	trans	-64.7	-46.1	174.3	-171.5	173.7	-178.2	-179.1	0	111.3	R249 V250 F251 S256 S257	R249-K253 WeakPolarHBondContact O-CB 3.46Å; R249-K253 PolarHBondContact O-N 3.43Å; V250-K253 WeakPolarHBondContact O-CB 3.4Å; V250-K253 PolarHBondContact O-N 3.06Å; V250-K253 VanDerWaalsContact O-N 3.17Å; F251-K253 VanDerWaalsContact C-N 3.28Å; F251-K253 PolarHBondContact O-N 3.38Å; K253-S256 WeakPolarHBondContact CA-OG 3.31Å; K253-S256 PolarHBondContact O-N 3.42Å; K253-S256 PolarHBondContact O-OG 2.95Å; K253-S257 PolarHBondContact O-N 3.23Å; K253-S257 PolarHBondContact O-OG 3.29Å
254	V	72.1	Confident	67.8	Low	83 Å²	83	114.9 Å²	114.9	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-62.9	-43.8	176.5	172	0	0	0	0	111.9	V250 F251 S257 T258	V250-V254 WeakPolarHBondContact O-CG2 2.95Å; V250-V254 PolarHBondContact O-N 2.96Å; F251-V254 PolarHBondContact O-N 3.37Å; F251-V254 VanDerWaalsContact O-N 3.13Å; V254-S257 WeakPolarHBondContact CA-OG 3.4Å; V254-S257 PolarHBondContact O-N 3.45Å; V254-S257 PolarHBondContact O-OG 2.73Å; V254-T258 PolarHBondContact O-N 2.96Å; V254-T258 PolarHBondContact O-OG1 2.94Å
255	S	73.4	Confident	64.9	Low	59 Å²	59	118.5 Å²	118.5	41%	0.413	64%	0.636	S	S	.	*	H	α-helix	trans	-61.2	-47.2	173.6	-56.7	0	0	0	0	111.2	F251 S257 T258 D259	F251-S255 PolarHBondContact O-N 2.74Å; F251-S255 PolarHBondContact O-OG 3.26Å; F251-S255 VanDerWaalsContact O-OG 3.14Å; S255-S257 PolarHBondContact O-N 3.02Å; S255-T258 PolarHBondContact O-N 2.96Å; S255-D259 PolarHBondContact O-N 2.72Å
256	S	59.3	Low	62.2	Low	81 Å²	81	122.9 Å²	122.9	57%	0.566	66%	0.655	S	S	*	*	H	α-helix	trans	-68.2	-17.4	179.3	69.3	0	0	0	0	114.8	K252 K253	K252-S256 VanDerWaalsContact O-CB 3.26Å; K252-S256 WeakPolarHBondContact O-CB 3.41Å; K252-S256 PolarHBondContact O-N 2.76Å; K252-S256 PolarHBondContact O-OG 2.76Å; K253-S256 WeakPolarHBondContact CA-OG 3.31Å; K253-S256 PolarHBondContact O-N 3.42Å; K253-S256 PolarHBondContact O-OG 2.95Å
257	S	56.3	Low	59.5	Low	92 Å²	92	130.4 Å²	130.4	64%	0.643	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-1.1	171.3	60	0	0	0	0	114	K253 V254 S255	K253-S257 PolarHBondContact O-N 3.23Å; K253-S257 PolarHBondContact O-OG 3.29Å; V254-S257 WeakPolarHBondContact CA-OG 3.4Å; V254-S257 PolarHBondContact O-N 3.45Å; V254-S257 PolarHBondContact O-OG 2.73Å; S255-S257 PolarHBondContact O-N 3.02Å
258	T	48.8	Very low	56.5	Low	109 Å²	109	132.8 Å²	132.8	67%	0.669	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	-17	-177.9	-52	0	0	0	0	112.4	V254 S255	V254-T258 PolarHBondContact O-N 2.96Å; V254-T258 PolarHBondContact O-OG1 2.94Å; S255-T258 PolarHBondContact O-N 2.96Å
259	D	45	Very low	53.4	Low	135 Å²	135	133.2 Å²	133.2	72%	0.722	70%	0.701	S	S	*	*			trans	-112.4	50.9	-165.1	-157.9	19.8	0	0	0	113	S255	S255-D259 PolarHBondContact O-N 2.72Å
260	M	46.4	Very low	50.5	Low	169 Å²	169	130.6 Å²	130.6	83%	0.833	71%	0.709	S	S	*	*			trans	-139.6	38.6	179.5	-84.8	-72.4	99.7	0	0	113.5
261	D	44.3	Very low	48	Very low	156 Å²	156	133 Å²	133	83%	0.834	72%	0.724	S	S	*	*	S	Bend	trans	-159.7	91.3	151.3	-133.7	-15.2	0	0	0	113
262	I	37.8	Very low	45.6	Very low	164 Å²	164	132.2 Å²	132.2	84%	0.841	73%	0.733	S	S	*	*			trans	-178.8	134.8	146.5	-98.7	156.7	0	0	0	109.6
263	S	31.8	Very low	42.8	Very low	107 Å²	107	133 Å²	133	75%	0.748	74%	0.739	S	S	*	*			trans	-101.5	130.1	-178.6	-178.5	0	0	0	0	112.2
264	P	44.7	Very low	40.4	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	75%	0.745	S	S	*	*			trans	-106.1	125.2	171.8	35.1	-27.2	0	0	0	112.5
265	Q	29.8	Very low	38.3	Very low	157 Å²	157	136.6 Å²	136.6	73%	0.734	76%	0.755	S	S	*	*			trans	-136.5	122.3	173.7	-176.1	163.1	-29.6	0	0	112.4
266	Q	32	Very low	36	Very low	157 Å²	157	140.3 Å²	140.3	73%	0.734	77%	0.768	S	S	*	*			trans	70.6	121.9	176.2	-63.5	162.4	-2.7	0	0	114
267	R	30.2	Very low	34.4	Very low	235 Å²	235	141.4 Å²	141.4	89%	0.887	78%	0.776	S	S	*	*				57.1	134.1	72.6	-59.9	-172	-165	170	4.3	111.8
268	V	26.8	Very low	33	Very low	141 Å²	141	145 Å²	145	86%	0.855	79%	0.787	S	S	*	*			cis	-139.7	-172.8	22.1	-138.4	0	0	0	0	112.2
269	C	23.6	Very low	31.9	Very low	113 Å²	113	143.5 Å²	143.5	76%	0.764	79%	0.793	S	S	*	*			trans	-78.1	175	-170.5	-49.4	0	0	0	0	116.4
270	S	27.5	Very low	31.2	Very low	115 Å²	115	141.9 Å²	141.9	80%	0.804	80%	0.799	S	S	*	*			trans	100.5	116.4	147.5	-54.1	0	0	0	0	118.8
271	T	29.9	Very low	30.4	Very low	137 Å²	137	140.2 Å²	140.2	84%	0.84	79%	0.793	S	S	*	*			trans	-63.3	156.5	147.4	29.4	0	0	0	0	110.8
272	P	36.4	Very low	29.9	Very low	125 Å²	125	142.2 Å²	142.2	81%	0.812	79%	0.789	S	S	*	*				-137.1	-175.5	116.6	39.5	-29.6	0	0	0	113.8
273	E	25.1	Very low	29.6	Very low	180 Å²	180	142.8 Å²	142.8	84%	0.841	79%	0.786	S	S	*	*			trans	-86.9	160.3	-166	-59.8	166.1	89.2	0	0	115.2
274	M	27.8	Very low	29.4	Very low	161 Å²	161	142.8 Å²	142.8	79%	0.793	79%	0.786	S	S	*	*			trans	53.9	123.5	133.3	-162.1	-155.7	-144.2	0	0	120.1
275	Q	26.9	Very low	28.8	Very low	152 Å²	152	145.1 Å²	145.1	71%	0.71	79%	0.79	S	S	*	*				166.9	134.1	114.4	-88.1	-174	17.4	0	0	115.6
276	I	25.7	Very low	28.6	Very low	136 Å²	136	141.6 Å²	141.6	70%	0.697	79%	0.788	S	S	*	*			trans	56.4	93.8	132.1	-52.5	172.8	0	0	0	120
277	S	25.4	Very low	29	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	78%	0.784	S	S	*	*				69.5	164.1	110.1	-149.9	0	0	0	0	123.4
278	L	27.5	Very low	28.8	Very low	166 Å²	166	133.8 Å²	133.8	87%	0.869	78%	0.775	S	S	*	*			trans	61.8	129.6	171.7	-75.1	114.6	0	0	0	119.9
279	G	25.8	Very low	29	Very low	78 Å²	78	134.5 Å²	134.5	80%	0.804	77%	0.768	S	S	*	*			trans	160.7	99	155.2	0	0	0	0	0	115.3
280	A	30.3	Very low	29.4	Very low	102 Å²	102	132.5 Å²	132.5	84%	0.843	76%	0.756	S	S	*	*			trans	-67	173.3	169	0	0	0	0	0	111.5
281	D	30.1	Very low	29.4	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	76%	0.758	S	S	*	*			cis	-166.8	154.2	21.5	-166.8	-7	0	0	0	109.8
282	R	32	Very low	29.4	Very low	199 Å²	199	132.7 Å²	132.7	75%	0.751	75%	0.747	S	S	*	*				164.3	126.7	120.3	-88.8	-173.9	-176.6	-68.2	3.1	115.7
283	K	32.3	Very low	29.2	Very low	176 Å²	176	134.8 Å²	134.8	77%	0.765	75%	0.746	S	S	*	*			trans	66.4	109.3	155.2	-63.3	175.7	175.2	-178.9	0	115.7
284	S	28.4	Very low	29.4	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	74%	0.741	S	S	*	*				77.1	102.8	55	-171.8	0	0	0	0	113.7
285	L	30.8	Very low	29.3	Very low	172 Å²	172	132.7 Å²	132.7	90%	0.901	74%	0.736	S	S	*	*				-159.1	153	101.3	-96.6	163.3	0	0	0	110.6
286	A	25.9	Very low	29.4	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	73%	0.732	S	S	*	*			trans	-111.1	-172.8	173.8	0	0	0	0	0	107.8
287	P	40.8	Very low	29.4	Very low	100 Å²	100	132.2 Å²	132.2	65%	0.649	74%	0.738	S	S	*	*			cis	-146.4	-175.7	9.5	45.3	-25.7	0	0	0	117.6
288	D	26.1	Very low	29.4	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	74%	0.739	S	S	*	*			trans	67.7	156.7	143.8	-70.6	-29.1	0	0	0	121.4
289	H	31	Very low	29.5	Very low	155 Å²	155	135 Å²	135	72%	0.718	74%	0.737	S	S	*	*			cis	-148.6	146.2	2.4	-133.3	-61.5	0	0	0	112.4
290	S	31.7	Very low	29.6	Very low	72 Å²	72	135.6 Å²	135.6	50%	0.503	73%	0.729	S	S	.	*			trans	55.4	126.9	142	-82	0	0	0	0	125.8
291	Q	28.3	Very low	29.4	Very low	182 Å²	182	134.5 Å²	134.5	85%	0.85	72%	0.715	S	S	*	*				72.6	160	123	-63.6	171.6	-21.5	0	0	119.7
292	A	29.8	Very low	29.2	Very low	74 Å²	74	135.8 Å²	135.8	61%	0.612	72%	0.717	S	S	*	*			cis	-156.8	156.2	3.3	0	0	0	0	0	112.9
293	E	31.2	Very low	28.9	Very low	169 Å²	169	133.6 Å²	133.6	79%	0.79	72%	0.719	S	S	*	*			trans	50.5	-173.2	156.7	-44.5	-35	101.6	0	0	118.5
294	E	29	Very low	28.5	Very low	158 Å²	158	129.6 Å²	129.6	74%	0.738	71%	0.713	S	S	*	*			cis	-150.3	157	-22.9	-122.2	-130.9	133.3	0	0	104.2
295	M	27.3	Very low	28.3	Very low	138 Å²	138	132.5 Å²	132.5	68%	0.68	71%	0.714	S	S	*	*			cis	-160.5	174.9	-8.3	175	46.2	70	0	0	109.6
296	S	27.8	Very low	28.2	Very low	91 Å²	91	129.5 Å²	129.5	64%	0.636	71%	0.708	S	S	*	*			trans	-89.5	149.7	-169.9	-51.5	0	0	0	0	116.4
297	K	25.3	Very low	28.2	Very low	188 Å²	188	130.9 Å²	130.9	82%	0.817	71%	0.712	S	S	*	*			trans	174.4	129.3	134.2	-91.8	145.5	-167.3	163.9	0	108.8
298	S	27	Very low	27.5	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	72%	0.721	S	S	*	*			cis	65.5	137.3	43.9	86.3	0	0	0	0	113.1
299	R	27.7	Very low	27.6	Very low	222 Å²	222	132.9 Å²	132.9	84%	0.838	73%	0.725	S	S	*	*			cis	-167.5	157	24.7	-173.9	-158.3	172.1	155.9	1.7	111.8
300	S	28.6	Very low	27.5	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	73%	0.728	S	S	*	*			trans	67.6	155.9	154.3	-86.1	0	0	0	0	118.5
301	S	25.5	Very low	27.1	Very low	79 Å²	79	136 Å²	136	55%	0.552	74%	0.741	S	S	*	*			cis	-163.6	158.6	-10.9	-109.9	0	0	0	0	110.4
302	E	27.4	Very low	27.1	Very low	161 Å²	161	132 Å²	132	75%	0.752	73%	0.732	S	S	*	*			trans	29.4	142	142.7	-66	141.1	138.1	0	0	120.5
303	L	25.6	Very low	27	Very low	152 Å²	152	137 Å²	137	80%	0.796	74%	0.743	S	S	*	*			cis	-151.5	-178	18.6	-143	62.9	0	0	0	106.6
304	C	23.9	Very low	27	Very low	93 Å²	93	135.7 Å²	135.7	63%	0.628	74%	0.741	S	S	*	*			cis	-158.2	-175.3	14.3	-153.6	0	0	0	0	112.2
305	E	24.6	Very low	27.2	Very low	168 Å²	168	136.8 Å²	136.8	79%	0.785	75%	0.747	S	S	*	*			trans	-46.1	157.5	166.6	-63	169.5	101.1	0	0	115.8
306	S	28.6	Very low	27.4	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	75%	0.746	S	S	*	*			cis	-169.5	-178.7	-10.2	-90.2	0	0	0	0	106.9
307	S	26.1	Very low	27.7	Very low	113 Å²	113	140.3 Å²	140.3	79%	0.79	76%	0.759	S	S	*	*			cis	-153.2	164.7	15.5	-174.5	0	0	0	0	111.2
308	E	26	Very low	28.1	Very low	176 Å²	176	135.6 Å²	135.6	82%	0.822	76%	0.755	S	S	*	*			trans	-79.2	146.7	167.1	-64.8	165.8	124.3	0	0	110.3
309	A	27.9	Very low	28.5	Very low	93 Å²	93	138.7 Å²	138.7	77%	0.769	76%	0.762	S	S	*	*				65.2	154.9	85.7	0	0	0	0	0	114.3
310	Q	27.8	Very low	28.7	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	76%	0.759	S	S	*	*			cis	-164.4	165.4	1.8	-153.7	178.2	12.5	0	0	110.3
311	T	24.7	Very low	29	Very low	126 Å²	126	137 Å²	137	77%	0.773	77%	0.771	S	S	*	*			trans	70.1	167.6	168	83.9	0	0	0	0	116.6
312	S	27.2	Very low	29.2	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	78%	0.775	S	S	*	*			cis	-157.1	162.5	5.2	57.1	0	0	0	0	113.6
313	Q	27.6	Very low	29.6	Very low	180 Å²	180	137.4 Å²	137.4	84%	0.841	78%	0.78	S	S	*	*			trans	81.6	154	146	-152.4	158.8	-14.1	0	0	122
314	D	30.9	Very low	29.9	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	78%	0.779	S	S	*	*			trans	-77.4	156	-167.5	-47.6	-93.9	0	0	0	116.8
315	Q	32.8	Very low	30.4	Very low	182 Å²	182	145 Å²	145	85%	0.85	79%	0.791	S	S	*	*				-177.5	135.2	116.4	-98.9	174.5	35	0	0	115.7
316	T	32.3	Very low	30.9	Very low	109 Å²	109	142.7 Å²	142.7	67%	0.669	79%	0.79	S	S	*	*				49.7	122.8	127.1	-45.9	0	0	0	0	123.3
317	E	35.1	Very low	31.3	Very low	193 Å²	193	143.4 Å²	143.4	90%	0.902	79%	0.792	S	S	*	*			trans	71.8	164.2	150.3	-74.7	175.7	175.4	0	0	122.1
318	A	33.6	Very low	31.5	Very low	89 Å²	89	144.5 Å²	144.5	74%	0.736	79%	0.793	S	S	*	*			trans	-107.7	167.3	-157.4	0	0	0	0	0	113.7
319	L	34.3	Very low	31.7	Very low	173 Å²	173	142.7 Å²	142.7	91%	0.906	80%	0.795	S	S	*	*				-169.4	162.3	120.4	-102.5	170.4	0	0	0	113
320	S	32.8	Very low	31.7	Very low	109 Å²	109	146.8 Å²	146.8	76%	0.762	80%	0.798	S	S	*	*			trans	-78.7	149.5	-173.5	-46.7	0	0	0	0	114.1
321	L	34	Very low	31.7	Very low	168 Å²	168	146 Å²	146	88%	0.88	81%	0.805	S	S	*	*			trans	-144	143.3	156.8	-108.4	178.8	0	0	0	114.6
322	V	30.6	Very low	31.8	Very low	106 Å²	106	145.2 Å²	145.2	64%	0.642	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-75	132.3	-168.9	173	0	0	0	0	113.6	R324	V322-R324 HydrophobicContact CG1-CG 4.39Å
323	V	34.7	Very low	31.9	Very low	142 Å²	142	145.8 Å²	145.8	86%	0.861	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.9	129	162.1	179.2	0	0	0	0	110.1
324	R	33.2	Very low	31.9	Very low	202 Å²	202	143.3 Å²	143.3	76%	0.762	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-97.4	153.7	-178.8	-69.2	177.6	170.9	82.2	-5.2	112.1	V322	V322-R324 HydrophobicContact CG1-CG 4.39Å
325	K	34	Very low	31.9	Very low	203 Å²	203	142.5 Å²	142.5	88%	0.883	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71	143.8	168.4	-68.8	177.2	176.9	175.3	0	111.3
326	P	35.5	Very low	32.3	Very low	119 Å²	119	138.7 Å²	138.7	77%	0.773	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.3	159.8	165.2	33.2	-33.8	0	0	0	112.3
327	P	36.6	Very low	32	Very low	123 Å²	123	139.7 Å²	139.7	80%	0.799	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-99	172.4	-168.8	38.9	-37	0	0	0	115.6
328	V	30.2	Very low	31.6	Very low	136 Å²	136	136 Å²	136	82%	0.824	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-90.6	150.6	174.8	175.6	0	0	0	0	111.2
329	T	28.9	Very low	31.4	Very low	138 Å²	138	141.5 Å²	141.5	85%	0.847	80%	0.8	S	S	*	*			trans	-117.4	142.1	169.8	-41.4	0	0	0	0	110.7
330	Q	29.1	Very low	31.1	Very low	180 Å²	180	142.5 Å²	142.5	84%	0.841	79%	0.792	S	S	*	*			trans	-105.1	149.7	-175.5	-64.8	178.5	-13.3	0	0	112.7
331	V	28.4	Very low	31.3	Very low	152 Å²	152	143 Å²	143	92%	0.921	79%	0.792	S	S	*	*			trans	-140.4	148.8	158.9	-166.2	0	0	0	0	107.3
332	S	26.9	Very low	30.9	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	79%	0.785	S	S	*	*			trans	-145.6	164.6	-165.3	-168.6	0	0	0	0	114.9
333	S	28.8	Very low	30.8	Very low	109 Å²	109	142.4 Å²	142.4	76%	0.762	79%	0.785	S	S	*	*			trans	69.6	150.8	-178	79.2	0	0	0	0	115.1
334	V	26.7	Very low	30.5	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	78%	0.778	S	S	*	*			cis	-133.8	159.3	16.9	174.1	0	0	0	0	111.1
335	T	31.2	Very low	30.2	Very low	124 Å²	124	140.3 Å²	140.3	76%	0.761	78%	0.782	S	S	*	*			trans	-124.5	167.3	166.8	65.1	0	0	0	0	110.7
336	P	41.1	Very low	30.1	Very low	102 Å²	102	138.8 Å²	138.8	66%	0.662	78%	0.778	S	S	*	*				-155.8	148.3	103.8	37.8	-19.3	0	0	0	118.5
337	T	27.3	Very low	29.7	Very low	129 Å²	129	139.2 Å²	139.2	79%	0.791	78%	0.779	S	S	*	*			trans	64.7	158.1	149.6	56.2	0	0	0	0	119.8
338	V	26.6	Very low	29.9	Very low	117 Å²	117	137.7 Å²	137.7	71%	0.709	77%	0.769	S	S	*	*			cis	-143.3	153.8	12.9	-142.2	0	0	0	0	113.8
339	K	28.4	Very low	29.8	Very low	204 Å²	204	140.2 Å²	140.2	89%	0.887	77%	0.769	S	S	*	*			trans	86.8	147.4	151.4	-85.2	156.5	-174.5	174.3	0	122.2
340	R	28	Very low	29.7	Very low	194 Å²	194	142.3 Å²	142.3	73%	0.732	77%	0.769	S	S	*	*			trans	-133.7	176.2	-167.1	-159.4	155.9	171.5	98.4	0.9	105	Y342	R340-Y342 VanDerWaalsContact NH2-CE2 3.33Å
341	P	36.3	Very low	29.7	Very low	119 Å²	119	142.4 Å²	142.4	77%	0.773	77%	0.767	S	S	*	*			cis	-153.1	-177.7	31.2	44.7	-21	0	0	0	121.6
342	Y	26	Very low	29.5	Very low	182 Å²	182	140.6 Å²	140.6	71%	0.714	76%	0.761	S	S	*	*			trans	-70.9	-176.5	163.3	-72.6	-119.9	0	0	0	111.2	R340	R340-Y342 VanDerWaalsContact NH2-CE2 3.33Å
343	A	28.2	Very low	29.7	Very low	80 Å²	80	145.1 Å²	145.1	66%	0.661	76%	0.763	S	S	*	*			cis	-160.8	156.4	14.7	0	0	0	0	0	114.1
344	V	28.5	Very low	29.6	Very low	115 Å²	115	146.3 Å²	146.3	70%	0.697	77%	0.766	S	S	*	*				40.5	131	129.2	178.9	0	0	0	0	120.8
345	H	27.4	Very low	29.9	Very low	184 Å²	184	145.7 Å²	145.7	85%	0.852	77%	0.765	S	S	*	*				-172.4	153.5	117.8	-101.2	-70.7	0	0	0	113.6
346	Q	32.2	Very low	30.6	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	77%	0.767	S	S	*	*			trans	-147.4	-175.1	179	-119.4	-161.9	34.3	0	0	110.1
347	T	27	Very low	30.4	Very low	128 Å²	128	148.8 Å²	148.8	79%	0.785	78%	0.777	S	S	*	*			trans	93.6	159.1	168.8	75.4	0	0	0	0	117.8
348	P	41.7	Very low	31.2	Very low	91 Å²	91	148 Å²	148	59%	0.591	76%	0.764	S	S	*	*			cis	-135	179.1	-14.2	22.6	2.1	0	0	0	116.4
349	F	27.5	Very low	32	Very low	188 Å²	188	151.1 Å²	151.1	83%	0.825	77%	0.771	S	S	*	*			trans	73.4	155.8	159.8	-58.8	-56.6	0	0	0	118.8
350	Q	27.1	Very low	32.5	Very low	183 Å²	183	145.1 Å²	145.1	86%	0.855	76%	0.755	S	S	*	*			cis	-144.4	165.8	6.8	-146.1	165	15.4	0	0	113.2
351	F	28.6	Very low	33.1	Very low	181 Å²	181	140.5 Å²	140.5	79%	0.794	74%	0.741	S	S	*	*			trans	-93.2	152.9	-179.1	-129.6	-106.5	0	0	0	112.5	Y353	F351-Y353 HydrophobicContact CD1-CD2 4.13Å; F351-Y353 AromaticContact CE1-CD2 3.76Å; F351-Y353 HydrophobicContact CE1-CD2 3.76Å; F351-Y353 AromaticContact CE1-CE2 3.96Å; F351-Y353 HydrophobicContact CE1-CE2 3.96Å
352	S	24	Very low	33.7	Very low	115 Å²	115	141 Å²	141	80%	0.804	74%	0.736	S	S	*	*			trans	-149	149.8	162	61.1	0	0	0	0	111.3
353	Y	30.6	Very low	34.7	Very low	203 Å²	203	137.4 Å²	137.4	80%	0.796	73%	0.729	S	S	*	*			trans	-150.5	125.4	-169.8	-134	-93.9	0	0	0	110.4	F351	F351-Y353 HydrophobicContact CD1-CD2 4.13Å; F351-Y353 AromaticContact CE1-CD2 3.76Å; F351-Y353 HydrophobicContact CE1-CD2 3.76Å; F351-Y353 AromaticContact CE1-CE2 3.96Å; F351-Y353 HydrophobicContact CE1-CE2 3.96Å
354	T	28	Very low	35.4	Very low	134 Å²	134	138.1 Å²	138.1	82%	0.822	72%	0.718	S	S	*	*			trans	-164.8	164.6	171.8	13.8	0	0	0	0	109.5
355	P	32.2	Very low	36.2	Very low	114 Å²	114	139.1 Å²	139.1	74%	0.74	72%	0.715	S	S	*	*			trans	-93.4	169.1	-135.4	-7.7	28.3	0	0	0	116.9
356	P	45.6	Very low	37.2	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	71%	0.706	S	S	*	*			trans	-84.7	117.9	-171.6	32.8	-33.8	0	0	0	113.6
357	L	38.2	Very low	38.1	Very low	166 Å²	166	134 Å²	134	87%	0.869	70%	0.698	S	S	*	*			trans	-148.3	72.8	169.8	-73.6	179.1	0	0	0	112.3
358	H	44.3	Very low	39	Very low	112 Å²	112	134.4 Å²	134.4	52%	0.519	69%	0.689	S	S	.	*			trans	-165.1	34.4	141.8	-124.3	-57.9	0	0	0	119.7	S360 H361	H358-S360 PolarHBondContact CE1-OG 3.22Å; H358-S360 PolarHBondContact ND1-OG 2.88Å; H358-S360 PolarHBondContact O-N 3.49Å; H358-H361 AromaticContact CE1-CD2 3.29Å; H358-H361 PolarHBondContact CE1-CD2 3.4Å; H358-H361 AromaticContact CE1-CE1 3.36Å; H358-H361 PolarHBondContact CE1-CE1 2.92Å; H358-H361 AromaticContact CE1-CG 3.5Å; H358-H361 AromaticContact CE1-ND1 3.54Å; H358-H361 AromaticContact CE1-NE2 3.21Å; H358-H361 PolarHBondContact CE1-NE2 3.43Å; H358-H361 AromaticContact CG-CD2 3.73Å; H358-H361 AromaticContact ND1-CD2 3.16Å; H358-H361 PolarHBondContact ND1-CD2 3.41Å; H358-H361 AromaticContact ND1-CE1 3.95Å; H358-H361 AromaticContact ND1-CG 3.28Å; H358-H361 VanDerWaalsContact ND1-CG 3.28Å; H358-H361 AromaticContact ND1-ND1 3.78Å; H358-H361 AromaticContact ND1-NE2 3.63Å; H358-H361 AromaticContact NE2-CD2 3.91Å; H358-H361 AromaticContact NE2-NE2 3.62Å; H358-H361 PolarHBondContact O-N 2.99Å
359	E	42.3	Very low	39	Very low	184 Å²	184	140.4 Å²	140.4	86%	0.86	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-23.3	-177.6	-160.9	162.8	-134.8	0	0	114.7	H361	E359-H361 PolarHBondContact O-N 2.86Å
360	S	39.7	Very low	39.6	Very low	78 Å²	78	133.7 Å²	133.7	55%	0.545	69%	0.685	S	S	.	*	H	α-helix	trans	-69.5	-26.1	-176.4	52.2	0	0	0	0	116.1	H358 E364	H358-S360 PolarHBondContact CE1-OG 3.22Å; H358-S360 PolarHBondContact ND1-OG 2.88Å; H358-S360 PolarHBondContact O-N 3.49Å; S360-E364 PolarHBondContact O-N 2.93Å
361	H	40.6	Very low	40.1	Very low	97 Å²	97	131 Å²	131	45%	0.449	68%	0.684	S	S	.	*	H	α-helix	trans	-74.5	-30.8	-171.9	-85.4	-18.5	0	0	0	114	H358 E359 H365	H358-H361 AromaticContact CE1-CD2 3.29Å; H358-H361 PolarHBondContact CE1-CD2 3.4Å; H358-H361 AromaticContact CE1-CE1 3.36Å; H358-H361 PolarHBondContact CE1-CE1 2.92Å; H358-H361 AromaticContact CE1-CG 3.5Å; H358-H361 AromaticContact CE1-ND1 3.54Å; H358-H361 AromaticContact CE1-NE2 3.21Å; H358-H361 PolarHBondContact CE1-NE2 3.43Å; H358-H361 AromaticContact CG-CD2 3.73Å; H358-H361 AromaticContact ND1-CD2 3.16Å; H358-H361 PolarHBondContact ND1-CD2 3.41Å; H358-H361 AromaticContact ND1-CE1 3.95Å; H358-H361 AromaticContact ND1-CG 3.28Å; H358-H361 VanDerWaalsContact ND1-CG 3.28Å; H358-H361 AromaticContact ND1-ND1 3.78Å; H358-H361 AromaticContact ND1-NE2 3.63Å; H358-H361 AromaticContact NE2-CD2 3.91Å; H358-H361 AromaticContact NE2-NE2 3.62Å; H358-H361 PolarHBondContact O-N 2.99Å; E359-H361 PolarHBondContact O-N 2.86Å; H361-H365 PolarHBondContact O-N 2.78Å; H361-H365 PolarHBondContact O-ND1 2.61Å
362	I	49	Very low	40.5	Very low	128 Å²	128	131.2 Å²	131.2	66%	0.656	69%	0.687	S	S	*	*	H	α-helix	trans	-70.2	-40.2	-178.2	-61.4	175.4	0	0	0	110	L366	I362-L366 HydrophobicContact CG2-CD1 4.38Å; I362-L366 WeakPolarHBondContact O-CG 3.46Å; I362-L366 PolarHBondContact O-N 3.21Å
363	L	46	Very low	40.8	Very low	108 Å²	108	131.2 Å²	131.2	57%	0.565	69%	0.687	S	S	*	*	H	α-helix	trans	-72.5	-37.5	-179.3	-167.2	63.2	0	0	0	112.5	H365 L366 L367	L363-H365 PolarHBondContact O-N 2.66Å; L363-L366 PolarHBondContact O-N 2.95Å; L363-L367 HydrophobicContact CD1-CD1 4.37Å; L363-L367 HydrophobicContact CG-CD1 3.94Å; L363-L367 WeakPolarHBondContact O-CG 3.41Å; L363-L367 PolarHBondContact O-N 2.91Å; L363-L367 VanDerWaalsContact O-N 3.11Å
364	E	42.6	Very low	40.9	Very low	94 Å²	94	129.1 Å²	129.1	44%	0.439	69%	0.689	S	S	.	*	H	α-helix	trans	-61.9	-42.5	177.9	-162.8	-163.3	151.4	0	0	112	S360 L366 L367 K368	S360-E364 PolarHBondContact O-N 2.93Å; E364-L366 VanDerWaalsContact C-N 3.28Å; E364-L366 PolarHBondContact O-N 3.23Å; E364-L367 PolarHBondContact O-N 3.12Å; E364-K368 PolarHBondContact O-N 3.25Å; E364-K368 IonicContact OE1-NZ 3.82Å; E364-K368 PolarHBondContact OE1-NZ 3.37Å
365	H	46.3	Very low	41.2	Very low	137 Å²	137	133.3 Å²	133.3	63%	0.634	70%	0.696	S	S	*	*	H	α-helix	trans	-67	-27.8	178.9	-74.9	87.5	0	0	0	113.3	H361 L363	H361-H365 PolarHBondContact O-N 2.78Å; H361-H365 PolarHBondContact O-ND1 2.61Å; L363-H365 PolarHBondContact O-N 2.66Å
366	L	47.8	Very low	41.1	Very low	125 Å²	125	131.7 Å²	131.7	65%	0.654	70%	0.7	S	S	*	*	H	α-helix	trans	-78.2	-34.8	176.3	-71.6	168	0	0	0	112.6	I362 L363 E364	I362-L366 HydrophobicContact CG2-CD1 4.38Å; I362-L366 WeakPolarHBondContact O-CG 3.46Å; I362-L366 PolarHBondContact O-N 3.21Å; L363-L366 PolarHBondContact O-N 2.95Å; E364-L366 VanDerWaalsContact C-N 3.28Å; E364-L366 PolarHBondContact O-N 3.23Å
367	L	52	Low	40.3	Very low	122 Å²	122	130.6 Å²	130.6	64%	0.639	70%	0.702	S	S	*	*	H	α-helix	trans	-81.8	-20	-176.9	-71.5	170.7	0	0	0	114.2	L363 E364 Y369 G370	L363-L367 HydrophobicContact CD1-CD1 4.37Å; L363-L367 HydrophobicContact CG-CD1 3.94Å; L363-L367 WeakPolarHBondContact O-CG 3.41Å; L363-L367 PolarHBondContact O-N 2.91Å; L363-L367 VanDerWaalsContact O-N 3.11Å; E364-L367 PolarHBondContact O-N 3.12Å; L367-Y369 PolarHBondContact O-N 2.62Å; L367-G370 PolarHBondContact O-N 2.86Å
368	K	45.6	Very low	40.1	Very low	137 Å²	137	130.8 Å²	130.8	60%	0.596	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-2	-168.1	-147.1	154.2	-166.4	158.8	0	116.6	E364	E364-K368 PolarHBondContact O-N 3.25Å; E364-K368 IonicContact OE1-NZ 3.82Å; E364-K368 PolarHBondContact OE1-NZ 3.37Å
369	Y	41.4	Very low	39.7	Very low	218 Å²	218	131.2 Å²	131.2	86%	0.855	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.7	12.6	-178.2	-67.6	-77.4	0	0	0	114.5	L367	L367-Y369 PolarHBondContact O-N 2.62Å
370	G	40.1	Very low	39	Very low	47 Å²	47	128.7 Å²	128.7	49%	0.485	72%	0.717	S	S	.	*	S	Bend	trans	-91.1	138.1	171.6	0	0	0	0	0	112.5	L367	L367-G370 PolarHBondContact O-N 2.86Å
371	P	38.1	Very low	38.6	Very low	127 Å²	127	133 Å²	133	83%	0.825	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-69.2	140.3	172.3	29.6	-33.9	0	0	0	111.1
372	H	36.3	Very low	39.1	Very low	185 Å²	185	133.9 Å²	133.9	86%	0.856	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-66.5	130.9	-169.6	-55	-79.1	0	0	0	114.4
373	S	31	Very low	38.7	Very low	115 Å²	115	132.9 Å²	132.9	80%	0.804	75%	0.746	S	S	*	*			trans	-125.9	126.6	152.5	51	0	0	0	0	108.5
374	N	32.1	Very low	37.8	Very low	159 Å²	159	133.5 Å²	133.5	85%	0.85	76%	0.76	S	S	*	*			trans	-81	152.2	-172.3	-88.4	11.7	0	0	0	113.2
375	F	34.4	Very low	37.3	Very low	221 Å²	221	136.6 Å²	136.6	97%	0.969	78%	0.776	S	S	*	*			trans	-63.6	160.2	179.3	-88.8	-117.9	0	0	0	114.6
376	G	30.4	Very low	36.4	Very low	80 Å²	80	135.7 Å²	135.7	83%	0.825	78%	0.776	S	S	*	*			trans	170.9	92.4	158.3	0	0	0	0	0	114
377	A	28.9	Very low	35.6	Very low	102 Å²	102	139.8 Å²	139.8	84%	0.843	78%	0.783	S	S	*	*			trans	-98.7	154.1	173	0	0	0	0	0	112
378	L	33.7	Very low	34.3	Very low	171 Å²	171	140 Å²	140	90%	0.895	79%	0.789	S	S	*	*			trans	-86.8	155.1	179.5	-62.7	171.5	0	0	0	112.9
379	P	36.3	Very low	33.4	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	80%	0.797	S	S	*	*			trans	-122.2	-178.3	143.8	34.8	-23	0	0	0	112.8
380	C	27.6	Very low	34.3	Very low	130 Å²	130	133.1 Å²	133.1	88%	0.878	79%	0.788	S	S	*	*			trans	-87.6	171.3	-156.6	-61.2	0	0	0	0	118.4
381	M	30.3	Very low	33.7	Very low	168 Å²	168	138 Å²	138	83%	0.828	80%	0.803	S	S	*	*			trans	-55.1	172.4	174.7	-55.9	-75.9	92.9	0	0	116.2
382	P	51.1	Low	33.2	Very low	117 Å²	117	137.5 Å²	137.5	76%	0.76	80%	0.802	S	S	*	*			cis	-124.7	-127.1	-20.6	30.3	-5.5	0	0	0	109.3
383	P	41.8	Very low	33	Very low	106 Å²	106	135 Å²	135	69%	0.688	80%	0.8	S	S	*	*			cis	-134.8	-173.3	-32	39.6	-20.9	0	0	0	116.5
384	S	26.1	Very low	32.8	Very low	121 Å²	121	136.6 Å²	136.6	85%	0.846	80%	0.8	S	S	*	*			trans	87.5	174.4	152.7	78.2	0	0	0	0	121
385	M	31.2	Very low	32.9	Very low	160 Å²	160	136.1 Å²	136.1	79%	0.788	80%	0.796	S	S	*	*			trans	-102.9	150.3	-147.9	-60.5	167.2	54.8	0	0	115.8
386	D	27.5	Very low	32.5	Very low	117 Å²	117	129.8 Å²	129.8	63%	0.626	78%	0.779	S	S	*	*				158.6	158.7	98.1	-119.3	-48.8	0	0	0	115
387	R	30.8	Very low	32.5	Very low	211 Å²	211	137.4 Å²	137.4	80%	0.796	78%	0.783	S	S	*	*			trans	10.3	155.4	155.4	-72.6	162.6	-177.1	-89.7	-7.8	122.6
388	T	26.4	Very low	32.5	Very low	126 Å²	126	139.8 Å²	139.8	77%	0.773	78%	0.782	S	S	*	*			cis	-162.3	-179.9	15.1	-4.6	0	0	0	0	113.4
389	S	25.6	Very low	32.3	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	77%	0.772	S	S	*	*			trans	-98.6	-165.7	177.7	-44.1	0	0	0	0	113.8
390	P	59.8	Low	31.9	Very low	103 Å²	103	137 Å²	137	67%	0.669	78%	0.778	S	S	*	*			cis	-135.2	-156.8	-43.3	31.5	-7.7	0	0	0	114.5
391	D	28.1	Very low	32.1	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	77%	0.766	S	S	*	*			trans	76.8	158.8	159.3	-54.8	-24.7	0	0	0	118.8
392	S	27.7	Very low	32	Very low	115 Å²	115	134.9 Å²	134.9	80%	0.804	77%	0.768	S	S	*	*			cis	-149.5	-171.7	15.5	-163.4	0	0	0	0	114.5
393	V	32.3	Very low	31.1	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	77%	0.774	S	S	*	*			trans	-93.3	166.3	-169.5	-60.9	0	0	0	0	116.6
394	D	27.5	Very low	30.5	Very low	150 Å²	150	141.1 Å²	141.1	80%	0.802	78%	0.782	S	S	*	*				-169.1	-174.9	118.4	-151.3	-2.3	0	0	0	113.5
395	L	33.6	Very low	30.9	Very low	149 Å²	149	144.7 Å²	144.7	78%	0.78	78%	0.782	S	S	*	*			trans	-123.5	174.5	-152.8	-77.9	154.2	0	0	0	118
396	S	25.3	Very low	30.9	Very low	87 Å²	87	144.1 Å²	144.1	61%	0.608	79%	0.787	S	S	*	*			trans	86.9	124.4	143.7	70.6	0	0	0	0	122.1
397	W	30.4	Very low	31.1	Very low	241 Å²	241	144.7 Å²	144.7	91%	0.913	80%	0.795	S	S	*	*				176.8	-179.5	100.2	-92.1	106.9	0	0	0	112.6
398	D	29.5	Very low	31	Very low	151 Å²	151	140.4 Å²	140.4	81%	0.807	80%	0.797	S	S	*	*			trans	-119	179.5	-153.5	-147.8	-24.9	0	0	0	114.6
399	A	29.6	Very low	31	Very low	83 Å²	83	138.4 Å²	138.4	69%	0.686	79%	0.788	S	S	*	*			trans	-83.8	167.9	-167.5	0	0	0	0	0	116.5
400	V	28.3	Very low	31.4	Very low	152 Å²	152	140 Å²	140	92%	0.921	78%	0.783	S	S	*	*			trans	-173.8	156.3	136.5	139.9	0	0	0	0	110.6
401	A	31	Very low	30.1	Very low	76 Å²	76	144.4 Å²	144.4	63%	0.628	79%	0.792	S	S	*	*			trans	-110.4	164.9	-172.8	0	0	0	0	0	114.2
402	M	28.3	Very low	30.2	Very low	176 Å²	176	140.7 Å²	140.7	87%	0.867	79%	0.79	S	S	*	*			trans	-170.2	174.5	139	-107.1	-48.1	111.1	0	0	115.4
403	R	31.9	Very low	30.5	Very low	233 Å²	233	143.2 Å²	143.2	88%	0.879	79%	0.788	S	S	*	*			trans	-84.7	158.9	-175.2	-59.2	169.1	159.8	-147	-1.6	114.5
404	S	29.7	Very low	30.5	Very low	122 Å²	122	144.5 Å²	144.5	85%	0.853	79%	0.785	S	S	*	*				-172.5	174.7	112.8	-156.5	0	0	0	0	113.6
405	K	34.5	Very low	30.4	Very low	196 Å²	196	144.6 Å²	144.6	85%	0.852	78%	0.781	S	S	*	*			trans	-106.5	152.7	169.6	-61.3	178.8	177.8	-178.1	0	110.6
406	V	30.8	Very low	30.1	Very low	147 Å²	147	148.6 Å²	148.6	89%	0.891	79%	0.785	S	S	*	*			trans	-168.5	164.1	137.1	130.8	0	0	0	0	110.9
407	T	32.8	Very low	31.2	Very low	129 Å²	129	149.2 Å²	149.2	79%	0.791	79%	0.788	S	S	*	*			trans	-86.9	148.8	-176.2	52.1	0	0	0	0	114.3
408	S	28	Very low	31	Very low	122 Å²	122	143 Å²	143	85%	0.853	78%	0.781	S	S	*	*				-170.5	157.2	125	-160.7	0	0	0	0	111.8
409	S	27.1	Very low	30.9	Very low	83 Å²	83	140.7 Å²	140.7	58%	0.58	78%	0.777	S	S	*	*			trans	-101.8	147.9	170.1	46.8	0	0	0	0	111.5
410	H	32.7	Very low	30.8	Very low	143 Å²	143	145.5 Å²	145.5	66%	0.662	79%	0.787	S	S	*	*				156.5	141.3	120.9	-90.4	-75	0	0	0	114.9
411	F	34.2	Very low	30.7	Very low	195 Å²	195	141.7 Å²	141.7	86%	0.855	78%	0.778	S	S	*	*			trans	50.7	142.5	156.8	-56.8	-58.8	0	0	0	122.1
412	G	29.2	Very low	30.5	Very low	73 Å²	73	142.7 Å²	142.7	75%	0.753	79%	0.787	S	S	*	*			trans	119	80	136.8	0	0	0	0	0	119.2
413	H	34.3	Very low	30.6	Very low	167 Å²	167	140.8 Å²	140.8	77%	0.773	79%	0.785	S	S	*	*			trans	40.5	122.7	139.5	-81	-22	0	0	0	123.6
414	H	31.1	Very low	30.5	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.736	78%	0.781	S	S	*	*				91.5	134.8	126.7	-69.3	-43	0	0	0	123.6
415	H	26.6	Very low	30.5	Very low	153 Å²	153	133.6 Å²	133.6	71%	0.708	78%	0.776	S	S	*	*			trans	60.8	103	151.7	-56.6	-47.4	0	0	0	122.7
416	R	27.8	Very low	30.1	Very low	232 Å²	232	131.5 Å²	131.5	88%	0.875	78%	0.775	S	S	*	*				46.9	147.6	106.8	-165.6	-174.4	-170	-149.9	3.1	119.5
417	P	48.3	Very low	30.1	Very low	101 Å²	101	127.7 Å²	127.7	66%	0.656	77%	0.765	S	S	*	*			cis	-126.3	-174.9	-25.9	35.2	-17.6	0	0	0	113.3
418	S	26.1	Very low	30	Very low	109 Å²	109	130 Å²	130	76%	0.762	77%	0.772	S	S	*	*				165.3	157.5	120.4	-74.5	0	0	0	0	114.8
419	S	26.9	Very low	30	Very low	104 Å²	104	130 Å²	130	73%	0.727	77%	0.77	S	S	*	*			trans	44.4	117.1	152.6	-153.8	0	0	0	0	119.3
420	M	27.3	Very low	30.4	Very low	184 Å²	184	133.1 Å²	133.1	91%	0.906	78%	0.78	S	S	*	*				50.3	130.3	74	-62.2	172	58.5	0	0	114
421	G	26.1	Very low	30.5	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	79%	0.787	S	S	*	*			cis	-177.4	-141.6	4.9	0	0	0	0	0	112.8
422	A	27.9	Very low	30.4	Very low	98 Å²	98	130.6 Å²	130.6	81%	0.81	78%	0.781	S	S	*	*			trans	67.4	107.1	-172.5	0	0	0	0	0	114.2
423	V	29.6	Very low	30.7	Very low	136 Å²	136	133.5 Å²	133.5	82%	0.824	78%	0.784	S	S	*	*			cis	81	115.6	38.7	-173.1	0	0	0	0	113.6
424	G	29.1	Very low	30.5	Very low	77 Å²	77	132 Å²	132	79%	0.794	78%	0.776	S	S	*	*			trans	-121.1	143.2	162.3	0	0	0	0	0	109.7
425	V	30	Very low	31.2	Very low	126 Å²	126	133 Å²	133	76%	0.764	78%	0.783	S	S	*	*			trans	-100.3	152	-169.2	-179.7	0	0	0	0	108.4
426	D	27.4	Very low	31.3	Very low	152 Å²	152	132.1 Å²	132.1	81%	0.813	78%	0.779	S	S	*	*			cis	-142.9	171.5	15.5	-144.1	-35.9	0	0	0	112
427	G	28.7	Very low	31.9	Very low	67 Å²	67	127.5 Å²	127.5	69%	0.691	78%	0.782	S	S	*	*			trans	172.4	108.3	171.1	0	0	0	0	0	116.2	C429	G427-C429 PolarHBondContact O-N 2.85Å
428	L	32.4	Very low	31.4	Very low	177 Å²	177	125 Å²	125	93%	0.927	78%	0.775	S	S	*	*			trans	-71.8	117.8	179.9	-63.3	169.2	0	0	0	113.2
429	C	27.6	Very low	32	Very low	123 Å²	123	128.2 Å²	128.2	83%	0.831	78%	0.778	S	S	*	*			trans	-158.1	147	152.4	-164.7	0	0	0	0	112	G427	G427-C429 PolarHBondContact O-N 2.85Å
430	L	35.3	Very low	32.8	Very low	148 Å²	148	130.5 Å²	130.5	78%	0.775	78%	0.781	S	S	*	*			trans	-75.9	146.8	173.1	-60.3	94.9	0	0	0	111.1	H432	L430-H432 PolarHBondContact O-N 3.13Å
431	P	33.9	Very low	33.6	Very low	124 Å²	124	128.7 Å²	128.7	81%	0.805	77%	0.77	S	S	*	*			trans	-69.7	93.3	165.2	29.6	-32.8	0	0	0	109.7	V433	P431-V433 PolarHBondContact O-N 2.8Å
432	H	32.4	Very low	34.3	Very low	161 Å²	161	128.1 Å²	128.1	75%	0.745	76%	0.755	S	S	*	*			trans	-57.1	116.4	175.2	180	88.7	0	0	0	110.6	L430 K434	L430-H432 PolarHBondContact O-N 3.13Å; H432-K434 VanDerWaalsContact C-N 3.28Å; H432-K434 PolarHBondContact O-N 3.1Å
433	V	36.6	Very low	35.1	Very low	134 Å²	134	128.8 Å²	128.8	81%	0.812	74%	0.744	S	S	*	*			trans	-72.7	83.3	178.5	-176.9	0	0	0	0	109.5	P431 M435	P431-V433 PolarHBondContact O-N 2.8Å; V433-M435 VanDerWaalsContact C-N 3.35Å; V433-M435 PolarHBondContact O-N 3.01Å
434	K	29.9	Very low	36	Very low	137 Å²	137	125.2 Å²	125.2	60%	0.596	73%	0.729	S	S	*	*			trans	-75	89	172.1	-157	-168.5	-171.4	-157.1	0	109	H432 E436	H432-K434 VanDerWaalsContact C-N 3.28Å; H432-K434 PolarHBondContact O-N 3.1Å; K434-E436 VanDerWaalsContact C-N 3.28Å; K434-E436 HydrophobicContact CD-CG 3.76Å; K434-E436 WeakPolarHBondContact CE-OE1 3.49Å; K434-E436 HydrophobicContact CG-CG 3.84Å; K434-E436 VanDerWaalsContact NZ-CD 3.29Å; K434-E436 IonicContact NZ-OE1 3.25Å; K434-E436 PolarHBondContact NZ-OE1 3.16Å; K434-E436 IonicContact NZ-OE2 2.94Å; K434-E436 PolarHBondContact O-N 3.26Å
435	M	44.7	Very low	36.7	Very low	180 Å²	180	128.7 Å²	128.7	89%	0.887	72%	0.724	S	S	*	*			trans	-69.5	82.1	175.3	-174.5	-179.6	70.5	0	0	110.3	V433	V433-M435 VanDerWaalsContact C-N 3.35Å; V433-M435 PolarHBondContact O-N 3.01Å
436	E	30.5	Very low	37.4	Very low	134 Å²	134	131.6 Å²	131.6	63%	0.626	72%	0.722	S	S	*	*			trans	-85.7	143	175.6	-61.6	-141.2	121.9	0	0	112	K434 G438	K434-E436 VanDerWaalsContact C-N 3.28Å; K434-E436 HydrophobicContact CD-CG 3.76Å; K434-E436 WeakPolarHBondContact CE-OE1 3.49Å; K434-E436 HydrophobicContact CG-CG 3.84Å; K434-E436 VanDerWaalsContact NZ-CD 3.29Å; K434-E436 IonicContact NZ-OE1 3.25Å; K434-E436 PolarHBondContact NZ-OE1 3.16Å; K434-E436 IonicContact NZ-OE2 2.94Å; K434-E436 PolarHBondContact O-N 3.26Å; E436-G438 PolarHBondContact O-N 2.93Å
437	S	38.8	Very low	37.8	Very low	135 Å²	135	127.8 Å²	127.8	94%	0.944	70%	0.701	S	S	*	*	S	Bend	trans	-81.5	56.7	-169.2	-154.3	0	0	0	0	112.9
438	G	37.9	Very low	38.5	Very low	48 Å²	48	127.7 Å²	127.7	50%	0.495	69%	0.688	S	S	.	*			trans	-95.4	-24.3	-173.2	0	0	0	0	0	116.4	E436 L440 Q441	E436-G438 PolarHBondContact O-N 2.93Å; G438-L440 PolarHBondContact O-N 2.84Å; G438-Q441 WeakPolarHBondContact O-CB 3.44Å; G438-Q441 PolarHBondContact O-N 3.32Å; G438-Q441 VanDerWaalsContact O-N 3.08Å
439	E	38.9	Very low	39.1	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-15.7	-166.6	-68.5	-165.8	117.5	0	0	115.4	Q441 S442	E439-Q441 PolarHBondContact O-N 3.37Å; E439-S442 PolarHBondContact O-N 3.31Å
440	L	43.8	Very low	40.3	Very low	152 Å²	152	128.5 Å²	128.5	80%	0.796	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-18.4	173.5	-119	173.7	0	0	0	113.1	G438	G438-L440 PolarHBondContact O-N 2.84Å
441	Q	44.7	Very low	41	Very low	145 Å²	145	124 Å²	124	68%	0.678	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-38.8	177.5	-155.3	70.1	34.8	0	0	112.2	G438 E439 L443 A444	G438-Q441 WeakPolarHBondContact O-CB 3.44Å; G438-Q441 PolarHBondContact O-N 3.32Å; G438-Q441 VanDerWaalsContact O-N 3.08Å; E439-Q441 PolarHBondContact O-N 3.37Å; Q441-L443 PolarHBondContact O-N 3.24Å; Q441-A444 PolarHBondContact O-N 2.78Å
442	S	39.8	Very low	41.7	Very low	60 Å²	60	123 Å²	123	42%	0.42	64%	0.638	S	S	.	*	H	α-helix	trans	-73.4	-26.9	-170.6	-171.8	0	0	0	0	113.9	E439 A444 E445	E439-S442 PolarHBondContact O-N 3.31Å; S442-A444 VanDerWaalsContact C-N 3.25Å; S442-A444 PolarHBondContact O-N 3.47Å; S442-E445 PolarHBondContact O-N 2.8Å
443	L	45.3	Very low	42.7	Very low	112 Å²	112	122.9 Å²	122.9	59%	0.586	64%	0.642	S	S	*	*	H	α-helix	trans	-67.2	-27.4	177.3	-172.5	59.6	0	0	0	112.7	Q441 E445 R446	Q441-L443 PolarHBondContact O-N 3.24Å; L443-E445 VanDerWaalsContact C-N 3.34Å; L443-R446 PolarHBondContact O-N 3.02Å
444	A	48.3	Very low	43.4	Very low	60 Å²	60	121.7 Å²	121.7	50%	0.496	63%	0.631	S	S	.	*	H	α-helix	trans	-70.1	-30.8	176.2	0	0	0	0	0	112.6	Q441 S442 R446	Q441-A444 PolarHBondContact O-N 2.78Å; S442-A444 VanDerWaalsContact C-N 3.25Å; S442-A444 PolarHBondContact O-N 3.47Å; A444-R446 PolarHBondContact O-N 3.42Å
445	E	43.4	Very low	44.2	Very low	150 Å²	150	119.9 Å²	119.9	70%	0.701	63%	0.627	S	S	*	*	H	α-helix	trans	-72.8	-17	179.3	-59.1	176.9	142.3	0	0	112.4	S442 L443	S442-E445 PolarHBondContact O-N 2.8Å; L443-E445 VanDerWaalsContact C-N 3.34Å
446	R	44.3	Very low	44.3	Very low	188 Å²	188	117.5 Å²	117.5	71%	0.709	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-9.1	-175	-139	-175.5	-156.2	96	-2.1	115	L443 A444	L443-R446 PolarHBondContact O-N 3.02Å; A444-R446 PolarHBondContact O-N 3.42Å
447	N	36.8	Very low	45.7	Very low	72 Å²	72	120.5 Å²	120.5	39%	0.385	63%	0.628	S	S	.	*			trans	-132.2	74.9	-170.9	-74.9	-75	0	0	0	112.5	Y449 I450 T451	N447-Y449 PolarHBondContact O-N 2.94Å; N447-Y449 VanDerWaalsContact O-N 3.14Å; N447-I450 HydrophobicContact CB-CD1 4.24Å; N447-I450 HydrophobicContact CB-CG1 4.4Å; N447-I450 PolarHBondContact O-N 2.78Å; N447-I450 VanDerWaalsContact O-N 3.11Å; N447-T451 PolarHBondContact O-OG1 3.37Å
448	P	43.7	Very low	47.5	Very low	64 Å²	64	115.2 Å²	115.2	42%	0.416	59%	0.594	S	S	.	*	H	α-helix	trans	-54.3	-38	-176.6	20.8	-32.9	0	0	0	113.2	I450 T451 D452	P448-I450 PolarHBondContact O-N 2.91Å; P448-I450 VanDerWaalsContact O-N 3.11Å; P448-T451 CarbonylContact O-C 3.59Å; P448-T451 WeakPolarHBondContact O-CA 3.39Å; P448-T451 PolarHBondContact O-N 2.96Å; P448-D452 PolarHBondContact O-N 3.4Å
449	Y	45.1	Very low	50	Low	192 Å²	192	114.6 Å²	114.6	75%	0.753	58%	0.579	S	S	*	*	H	α-helix	trans	-62.2	-19.6	-178.4	-48.5	-67.9	0	0	0	115.4	N447	N447-Y449 PolarHBondContact O-N 2.94Å; N447-Y449 VanDerWaalsContact O-N 3.14Å
450	I	52.8	Low	52.6	Low	125 Å²	125	108.8 Å²	108.8	64%	0.641	56%	0.556	S	S	*	*	H	α-helix	trans	-88.1	-36	173	-61.1	180	0	0	0	109.8	N447 P448	N447-I450 HydrophobicContact CB-CD1 4.24Å; N447-I450 HydrophobicContact CB-CG1 4.4Å; N447-I450 PolarHBondContact O-N 2.78Å; N447-I450 VanDerWaalsContact O-N 3.11Å; P448-I450 PolarHBondContact O-N 2.91Å; P448-I450 VanDerWaalsContact O-N 3.11Å
451	T	50	Low	55	Low	53 Å²	53	107 Å²	107	33%	0.325	55%	0.553	S	S	.	*	H	α-helix	trans	-71.4	-36	179.5	-34.2	0	0	0	0	112.2	N447 P448 L453 N454 I455	N447-T451 PolarHBondContact O-OG1 3.37Å; P448-T451 CarbonylContact O-C 3.59Å; P448-T451 WeakPolarHBondContact O-CA 3.39Å; P448-T451 PolarHBondContact O-N 2.96Å; T451-L453 PolarHBondContact O-N 3.27Å; T451-N454 CarbonylContact O-C 3.53Å; T451-N454 WeakPolarHBondContact O-CA 3.44Å; T451-N454 WeakPolarHBondContact O-CB 3.13Å; T451-N454 PolarHBondContact O-N 2.77Å; T451-I455 HydrophobicContact CG2-CD1 3.61Å; T451-I455 HydrophobicContact CG2-CG1 4.12Å; T451-I455 WeakPolarHBondContact O-CG1 3.29Å; T451-I455 PolarHBondContact O-N 3.02Å
452	D	47.8	Very low	57.2	Low	103 Å²	103	103 Å²	103	55%	0.551	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.6	177.5	-74	-37.1	0	0	0	113.8	P448 N454	P448-D452 PolarHBondContact O-N 3.4Å; D452-N454 VanDerWaalsContact C-N 3.35Å
453	L	54.1	Low	59.8	Low	160 Å²	160	101.2 Å²	101.2	84%	0.838	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.9	172.3	-82	163.7	0	0	0	113.7	T451	T451-L453 PolarHBondContact O-N 3.27Å
454	N	49.7	Very low	62.2	Low	109 Å²	109	98.8 Å²	98.8	58%	0.583	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-22.1	174.7	-162.2	49.4	0	0	0	111.9	T451 D452 Q456	T451-N454 CarbonylContact O-C 3.53Å; T451-N454 WeakPolarHBondContact O-CA 3.44Å; T451-N454 WeakPolarHBondContact O-CB 3.13Å; T451-N454 PolarHBondContact O-N 2.77Å; D452-N454 VanDerWaalsContact C-N 3.35Å; N454-Q456 PolarHBondContact O-N 2.88Å
455	I	48.1	Very low	64.4	Low	99 Å²	99	98.9 Å²	98.9	51%	0.508	50%	0.503	S	S	.	.			trans	-88.4	82.7	179.3	-59.3	164	0	0	0	111	T451	T451-I455 HydrophobicContact CG2-CD1 3.61Å; T451-I455 HydrophobicContact CG2-CG1 4.12Å; T451-I455 WeakPolarHBondContact O-CG1 3.29Å; T451-I455 PolarHBondContact O-N 3.02Å
456	Q	47.4	Very low	66.9	Low	130 Å²	130	92.2 Å²	92.2	61%	0.607	47%	0.471	S	S	*	.	S	Bend	trans	-121.3	55.9	151.9	-87	-81.6	-66.5	0	0	108.9	N454 G458	N454-Q456 PolarHBondContact O-N 2.88Å; Q456-G458 PolarHBondContact O-N 3.19Å
457	E	58.1	Low	69.4	Low	197 Å²	197	83.2 Å²	83.2	92%	0.921	44%	0.438	S	S	*	.	S	Bend	trans	31.7	62.1	156.7	-158.6	175.1	-146.7	0	0	116
458	G	76.9	Confident	72.3	Confident	23 Å²	23	81.9 Å²	81.9	24%	0.237	43%	0.428	C	S	.	.	S	Bend	trans	-179.8	-7.2	-179.4	0	0	0	0	0	117.9	Q456	Q456-G458 PolarHBondContact O-N 3.19Å
459	L	91.3	Very high	74.8	Confident	36 Å²	36	78.9 Å²	78.9	19%	0.188	41%	0.409	C	S	.	.			trans	-127.9	128.5	170.7	-70.3	176.8	0	0	0	110.4	H463 V489 I495 Q498 L499 W502	L459-H463 HydrophobicContact CD2-CB 4.16Å; L459-V489 HydrophobicContact CD2-CG1 4.09Å; L459-V489 HydrophobicContact CD2-CG2 4.01Å; L459-I495 HydrophobicContact CD1-CG2 4.18Å; L459-I495 HydrophobicContact CD2-CG2 4.19Å; L459-I495 HydrophobicContact CG-CG1 4.45Å; L459-I495 HydrophobicContact CG-CG2 4.09Å; L459-Q498 HydrophobicContact CD1-CB 3.72Å; L459-Q498 HydrophobicContact CD1-CG 3.63Å; L459-L499 HydrophobicContact CD1-CD2 4.49Å; L459-L499 HydrophobicContact CD1-CG 4.13Å; L459-L499 HydrophobicContact CD2-CD1 4.34Å; L459-L499 HydrophobicContact CD2-CD2 4.07Å; L459-L499 HydrophobicContact CD2-CG 4.17Å; L459-W502 HydrophobicContact CB-CH2 3.91Å; L459-W502 HydrophobicContact CB-CZ2 4.35Å; L459-W502 HydrophobicContact CD1-CH2 4.04Å; L459-W502 HydrophobicContact CD1-CZ2 4.27Å; L459-W502 HydrophobicContact CD1-CZ3 4.39Å; L459-W502 HydrophobicContact CD2-CH2 4.35Å; L459-W502 HydrophobicContact CD2-CZ3 4.42Å; L459-W502 HydrophobicContact CG-CH2 4.33Å
460	T	93.3	Very high	77.2	Confident	54 Å²	54	69.8 Å²	69.8	33%	0.331	37%	0.373	S	S	.	.			trans	-109.9	169.4	-174.8	63.2	0	0	0	0	111.5	S462 H463 L464	T460-S462 PolarHBondContact O-N 3.18Å; T460-S462 PolarHBondContact OG1-N 3.41Å; T460-S462 PolarHBondContact OG1-OG 3.45Å; T460-H463 PolarHBondContact N-ND1 3.3Å; T460-H463 PolarHBondContact O-N 2.91Å; T460-H463 PolarHBondContact OG1-CD2 2.87Å; T460-H463 PolarHBondContact OG1-N 3.43Å; T460-H463 PolarHBondContact OG1-NE2 3.35Å; T460-L464 PolarHBondContact O-N 2.94Å; T460-L464 VanDerWaalsContact O-N 3.12Å
461	P	93.2	Very high	79.4	Confident	114 Å²	114	63.9 Å²	63.9	74%	0.74	34%	0.343	S	S	*	.	H	α-helix	trans	-58.8	-31.4	167.5	-25.5	36.1	0	0	0	113.9	L464 K465	P461-L464 WeakPolarHBondContact O-CB 3.09Å; P461-L464 PolarHBondContact O-N 2.75Å; P461-K465 PolarHBondContact O-N 3.01Å
462	S	91.9	Very high	81.6	Confident	62 Å²	62	61.7 Å²	61.7	43%	0.434	33%	0.329	S	S	.	.	H	α-helix	trans	-69.3	-39.1	174.2	56.3	0	0	0	0	111.7	T460 L464 K465 K466	T460-S462 PolarHBondContact O-N 3.18Å; T460-S462 PolarHBondContact OG1-N 3.41Å; T460-S462 PolarHBondContact OG1-OG 3.45Å; S462-L464 PolarHBondContact O-N 3.14Å; S462-K465 PolarHBondContact O-N 2.97Å; S462-K466 VanDerWaalsContact O-CB 3.29Å; S462-K466 WeakPolarHBondContact O-CB 3.38Å; S462-K466 PolarHBondContact O-N 3.37Å
463	H	94.6	Very high	84	Confident	22 Å²	22	58.4 Å²	58.4	10%	0.102	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-33.3	173.1	-56.9	170.9	0	0	0	111.2	L459 T460 A467 F486 V489 W502	L459-H463 HydrophobicContact CD2-CB 4.16Å; T460-H463 PolarHBondContact N-ND1 3.3Å; T460-H463 PolarHBondContact O-N 2.91Å; T460-H463 PolarHBondContact OG1-CD2 2.87Å; T460-H463 PolarHBondContact OG1-N 3.43Å; T460-H463 PolarHBondContact OG1-NE2 3.35Å; H463-A467 VanDerWaalsContact O-CB 3.22Å; H463-A467 WeakPolarHBondContact O-CB 3.49Å; H463-A467 PolarHBondContact O-N 3.41Å; H463-F486 HydrophobicContact CB-CD1 4.31Å; H463-F486 HydrophobicContact CB-CE1 4.05Å; H463-V489 WeakPolarHBondContact CE1-CG2 3.29Å; H463-V489 VanDerWaalsContact ND1-CG2 3.31Å; H463-V489 WeakPolarHBondContact ND1-CG2 3.12Å; H463-W502 HydrophobicContact CB-CH2 4.45Å; H463-W502 HydrophobicContact CB-CZ3 4.36Å
464	L	95.4	Very high	86	Confident	61 Å²	61	51.3 Å²	51.3	32%	0.319	27%	0.272	S	S	.	.	H	α-helix	trans	-70	-43.5	173.1	-178.6	64	0	0	0	112.7	T460 P461 S462 A467 K468 W502 F506	T460-L464 PolarHBondContact O-N 2.94Å; T460-L464 VanDerWaalsContact O-N 3.12Å; P461-L464 WeakPolarHBondContact O-CB 3.09Å; P461-L464 PolarHBondContact O-N 2.75Å; S462-L464 PolarHBondContact O-N 3.14Å; L464-A467 PolarHBondContact O-N 2.98Å; L464-K468 WeakPolarHBondContact O-CG 3.21Å; L464-K468 PolarHBondContact O-N 3.39Å; L464-W502 HydrophobicContact CB-CH2 3.79Å; L464-W502 HydrophobicContact CB-CZ2 4.15Å; L464-W502 HydrophobicContact CB-CZ3 4.03Å; L464-W502 HydrophobicContact CD1-CD2 3.65Å; L464-W502 HydrophobicContact CD1-CE3 3.86Å; L464-W502 HydrophobicContact CD1-CG 4.07Å; L464-W502 HydrophobicContact CD1-CH2 4.26Å; L464-W502 HydrophobicContact CD1-CZ2 4.07Å; L464-W502 HydrophobicContact CD1-CZ3 4.16Å; L464-F506 HydrophobicContact CD1-CE1 4.24Å; L464-F506 HydrophobicContact CD1-CZ 3.9Å
465	K	95.4	Very high	88.3	Confident	63 Å²	63	46.4 Å²	46.4	27%	0.274	25%	0.245	S	C	.	.	H	α-helix	trans	-56.9	-51.9	172.9	-177.7	-175.9	178.7	-178.4	0	110.1	P461 S462 A467 K468 L469 D553 L610	P461-K465 PolarHBondContact O-N 3.01Å; S462-K465 PolarHBondContact O-N 2.97Å; K465-A467 PolarHBondContact O-N 3.36Å; K465-K468 WeakPolarHBondContact O-CB 3.37Å; K465-K468 PolarHBondContact O-N 2.6Å; K465-K468 VanDerWaalsContact O-N 3.14Å; K465-L469 HydrophobicContact CG-CD1 4.2Å; K465-L469 WeakPolarHBondContact O-CG 3.23Å; K465-L469 PolarHBondContact O-N 3.21Å; K465-D553 WeakPolarHBondContact CE-OD2 3.43Å; K465-D553 IonicContact NZ-OD1 2.74Å; K465-D553 IonicContact NZ-OD2 2.73Å; K465-D553 PolarHBondContact NZ-OD2 3.44Å; K465-L610 HydrophobicContact CD-CB 4.25Å
466	K	95.1	Very high	90.6	Very high	9 Å²	9	44.8 Å²	44.8	4%	0.039	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-46.4	178.6	-174.2	169.8	176.3	178	0	112.2	S462 K468 L469 M470 F485 F486 F604 T606	S462-K466 VanDerWaalsContact O-CB 3.29Å; S462-K466 WeakPolarHBondContact O-CB 3.38Å; S462-K466 PolarHBondContact O-N 3.37Å; K466-K468 VanDerWaalsContact C-N 3.34Å; K466-K468 PolarHBondContact O-N 3.26Å; K466-L469 PolarHBondContact O-N 3.3Å; K466-M470 HydrophobicContact CG-SD 4.29Å; K466-M470 VanDerWaalsContact O-CG 3.29Å; K466-M470 WeakPolarHBondContact O-CG 3.17Å; K466-M470 PolarHBondContact O-N 2.99Å; K466-F485 WeakPolarHBondContact CE-O 3.41Å; K466-F485 PolarHBondContact NZ-O 2.97Å; K466-F486 HydrophobicContact CB-CE1 4.07Å; K466-F486 HydrophobicContact CB-CZ 4.48Å; K466-F486 HydrophobicContact CD-CD1 4.29Å; K466-F486 HydrophobicContact CD-CE1 3.88Å; K466-F486 HydrophobicContact CG-CE1 3.92Å; K466-F486 HydrophobicContact CG-CZ 4.24Å; K466-F604 WeakPolarHBondContact CE-O 3.25Å; K466-F604 HydrophobicContact CG-CD1 4.31Å; K466-F604 PolarHBondContact NZ-O 3.36Å; K466-T606 PolarHBondContact NZ-O 3.36Å
467	A	96.6	Very high	92.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-38.6	175.1	0	0	0	0	0	113	H463 L464 K465 F471 F486 W502 F503 F506	H463-A467 VanDerWaalsContact O-CB 3.22Å; H463-A467 WeakPolarHBondContact O-CB 3.49Å; H463-A467 PolarHBondContact O-N 3.41Å; L464-A467 PolarHBondContact O-N 2.98Å; K465-A467 PolarHBondContact O-N 3.36Å; A467-F471 PolarHBondContact O-N 3.08Å; A467-F486 HydrophobicContact CB-CZ 3.92Å; A467-W502 HydrophobicContact CB-CE3 3.97Å; A467-W502 HydrophobicContact CB-CZ3 4.32Å; A467-F503 HydrophobicContact CB-CE2 3.96Å; A467-F503 HydrophobicContact CB-CZ 4.27Å; A467-F503 VanDerWaalsContact O-CZ 3.28Å; A467-F503 WeakPolarHBondContact O-CZ 3.31Å; A467-F506 HydrophobicContact CB-CE2 4.02Å; A467-F506 HydrophobicContact CB-CZ 4.33Å
468	K	97.1	Very high	94.6	Very high	44 Å²	44	33 Å²	33	19%	0.191	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-35	175.5	-81.2	-170.7	154.4	-159.5	0	112.9	L464 K465 K466 F471 F506 H547 Y548	L464-K468 WeakPolarHBondContact O-CG 3.21Å; L464-K468 PolarHBondContact O-N 3.39Å; K465-K468 WeakPolarHBondContact O-CB 3.37Å; K465-K468 PolarHBondContact O-N 2.6Å; K465-K468 VanDerWaalsContact O-N 3.14Å; K466-K468 VanDerWaalsContact C-N 3.34Å; K466-K468 PolarHBondContact O-N 3.26Å; K468-F471 WeakPolarHBondContact O-CB 3.29Å; K468-F471 PolarHBondContact O-N 3.05Å; K468-F506 HydrophobicContact CB-CZ 4.41Å; K468-F506 HydrophobicContact CD-CE1 4.34Å; K468-F506 HydrophobicContact CD-CZ 4.49Å; K468-F506 HydrophobicContact CG-CD1 4.37Å; K468-F506 HydrophobicContact CG-CE1 3.64Å; K468-F506 HydrophobicContact CG-CE2 3.98Å; K468-F506 HydrophobicContact CG-CZ 3.41Å; K468-F506 VanDerWaalsContact CG-CZ 3.41Å; K468-H547 PolarHBondContact NZ-CD2 2.77Å; K468-H547 PolarHBondContact NZ-NE2 3.32Å; K468-H547 PolarHBondContact NZ-O 3.17Å; K468-Y548 HydrophobicContact CB-CD1 4.25Å; K468-Y548 WeakPolarHBondContact CB-O 3.48Å; K468-Y548 HydrophobicContact CG-CD1 4.24Å
469	L	96.5	Very high	95.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-80.8	-32.5	179.1	-62.3	174.4	0	0	0	112.5	K465 K466 F471 F472 N549 F554 F604 L610	K465-L469 HydrophobicContact CG-CD1 4.2Å; K465-L469 WeakPolarHBondContact O-CG 3.23Å; K465-L469 PolarHBondContact O-N 3.21Å; K466-L469 PolarHBondContact O-N 3.3Å; L469-F471 PolarHBondContact O-N 2.93Å; L469-F471 VanDerWaalsContact O-N 3.16Å; L469-F472 HydrophobicContact CD2-CD2 4.1Å; L469-F472 HydrophobicContact CD2-CE2 3.59Å; L469-F472 WeakPolarHBondContact O-CB 3.39Å; L469-F472 WeakPolarHBondContact O-CD2 3.38Å; L469-F472 PolarHBondContact O-N 3.01Å; L469-F472 VanDerWaalsContact O-N 3.13Å; L469-N549 HydrophobicContact CD2-CB 3.9Å; L469-F554 HydrophobicContact CD1-CB 4.02Å; L469-F554 HydrophobicContact CD1-CD2 4.41Å; L469-F554 HydrophobicContact CD1-CG 4.2Å; L469-F554 HydrophobicContact CD2-CB 3.86Å; L469-F554 HydrophobicContact CD2-CD1 3.88Å; L469-F554 HydrophobicContact CD2-CG 3.93Å; L469-F554 HydrophobicContact CG-CG 4.49Å; L469-F604 HydrophobicContact CB-CE1 3.91Å; L469-F604 HydrophobicContact CB-CZ 4.17Å; L469-L610 HydrophobicContact CD1-CD1 3.21Å
470	M	96.6	Very high	95.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-25.2	167.2	-70.7	167.1	71.3	0	0	112.7	K466 F472 Y473 T474 F485 F486 F503 I600 F604	K466-M470 HydrophobicContact CG-SD 4.29Å; K466-M470 VanDerWaalsContact O-CG 3.29Å; K466-M470 WeakPolarHBondContact O-CG 3.17Å; K466-M470 PolarHBondContact O-N 2.99Å; M470-F472 PolarHBondContact O-N 3.19Å; M470-Y473 PolarHBondContact O-N 3.3Å; M470-T474 PolarHBondContact O-N 2.99Å; M470-F485 HydrophobicContact CE-CB 3.51Å; M470-F485 HydrophobicContact CE-CD2 4.42Å; M470-F485 HydrophobicContact CE-CG 4.05Å; M470-F485 HydrophobicContact SD-CB 4.21Å; M470-F486 HydrophobicContact CE-CE2 3.85Å; M470-F486 HydrophobicContact CE-CZ 4.47Å; M470-F486 HydrophobicContact SD-CE2 3.51Å; M470-F486 VanDerWaalsContact SD-CE2 3.51Å; M470-F486 HydrophobicContact SD-CZ 3.52Å; M470-F486 VanDerWaalsContact SD-CZ 3.52Å; M470-F503 HydrophobicContact CB-CZ 4.09Å; M470-I600 HydrophobicContact CB-CD1 4.39Å; M470-I600 HydrophobicContact CE-CD1 3.44Å; M470-I600 VanDerWaalsContact CE-CD1 3.44Å; M470-I600 HydrophobicContact CG-CD1 4.33Å; M470-I600 HydrophobicContact CG-CG2 4.23Å; M470-F604 HydrophobicContact CG-CD1 3.61Å; M470-F604 HydrophobicContact CG-CE1 3.93Å; M470-F604 HydrophobicContact CG-CG 4.41Å
471	F	97.9	Very high	95.6	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.4	176.9	-166.2	-102.1	0	0	0	113.9	A467 K468 L469 Y473 T474 R475 F503 F506 R507 Y510 Y548	A467-F471 PolarHBondContact O-N 3.08Å; K468-F471 WeakPolarHBondContact O-CB 3.29Å; K468-F471 PolarHBondContact O-N 3.05Å; L469-F471 PolarHBondContact O-N 2.93Å; L469-F471 VanDerWaalsContact O-N 3.16Å; F471-Y473 PolarHBondContact O-N 3.48Å; F471-T474 WeakPolarHBondContact CA-O 3.32Å; F471-R475 HydrophobicContact CD2-CB 4.49Å; F471-R475 HydrophobicContact CD2-CG 4.13Å; F471-R475 HydrophobicContact CE1-CG 4.13Å; F471-R475 HydrophobicContact CE2-CB 3.93Å; F471-R475 HydrophobicContact CE2-CG 3.63Å; F471-R475 HydrophobicContact CZ-CB 4.34Å; F471-R475 HydrophobicContact CZ-CG 3.65Å; F471-F503 HydrophobicContact CB-CE1 4.44Å; F471-F503 HydrophobicContact CD2-CD1 4Å; F471-F503 HydrophobicContact CD2-CE1 4.19Å; F471-F506 HydrophobicContact CB-CD2 4.37Å; F471-F506 HydrophobicContact CD2-CB 3.52Å; F471-F506 AromaticContact CD2-CD2 3.92Å; F471-F506 HydrophobicContact CD2-CD2 3.92Å; F471-F506 HydrophobicContact CD2-CG 4.21Å; F471-F506 HydrophobicContact CE2-CB 3.38Å; F471-F506 HydrophobicContact CG-CB 4.14Å; F471-F506 HydrophobicContact CG-CD2 4.35Å; F471-F506 HydrophobicContact CZ-CB 3.91Å; F471-R507 HydrophobicContact CE2-CG 3.96Å; F471-R507 HydrophobicContact CZ-CG 4.26Å; F471-Y510 AromaticContact CE1-CD2 3.81Å; F471-Y510 HydrophobicContact CE1-CD2 3.81Å; F471-Y510 AromaticContact CE1-CG 3.98Å; F471-Y510 HydrophobicContact CE1-CG 3.98Å; F471-Y510 HydrophobicContact CZ-CD2 4.37Å; F471-Y510 HydrophobicContact CZ-CG 4.07Å; F471-Y548 HydrophobicContact CB-CD1 4.27Å; F471-Y548 HydrophobicContact CB-CE1 4.47Å; F471-Y548 AromaticContact CD1-CD1 3.96Å; F471-Y548 HydrophobicContact CD1-CD1 3.96Å; F471-Y548 HydrophobicContact CD1-CD2 4.14Å; F471-Y548 AromaticContact CD1-CE1 3.56Å; F471-Y548 HydrophobicContact CD1-CE1 3.56Å; F471-Y548 AromaticContact CD1-CE2 3.75Å; F471-Y548 HydrophobicContact CD1-CE2 3.75Å; F471-Y548 HydrophobicContact CD1-CG 4.26Å; F471-Y548 AromaticContact CD1-CZ 3.46Å; F471-Y548 VanDerWaalsContact CD1-CZ 3.46Å; F471-Y548 AromaticContact CE1-CE1 3.88Å; F471-Y548 HydrophobicContact CE1-CE1 3.88Å; F471-Y548 AromaticContact CE1-CE2 3.79Å; F471-Y548 HydrophobicContact CE1-CE2 3.79Å; F471-Y548 AromaticContact CE1-CZ 3.38Å; F471-Y548 VanDerWaalsContact CE1-OH 3.29Å; F471-Y548 WeakPolarHBondContact CE1-OH 3.48Å; F471-Y548 HydrophobicContact CG-CD1 4.28Å; F471-Y548 HydrophobicContact CG-CE1 4.01Å
472	F	97.3	Very high	95.7	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.035	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.6	173.7	-65.1	-57.5	0	0	0	113	L469 M470 Y548 N549 F554 V556 F560	L469-F472 HydrophobicContact CD2-CD2 4.1Å; L469-F472 HydrophobicContact CD2-CE2 3.59Å; L469-F472 WeakPolarHBondContact O-CB 3.39Å; L469-F472 WeakPolarHBondContact O-CD2 3.38Å; L469-F472 PolarHBondContact O-N 3.01Å; L469-F472 VanDerWaalsContact O-N 3.13Å; M470-F472 PolarHBondContact O-N 3.19Å; F472-Y548 HydrophobicContact CE1-CD2 4.21Å; F472-Y548 HydrophobicContact CZ-CD2 4.48Å; F472-Y548 HydrophobicContact CZ-CG 4.48Å; F472-N549 HydrophobicContact CE2-CB 4.05Å; F472-N549 HydrophobicContact CZ-CB 4.04Å; F472-F554 AromaticContact CD2-CD1 3.82Å; F472-F554 HydrophobicContact CD2-CD1 3.82Å; F472-F554 AromaticContact CD2-CE1 3.55Å; F472-F554 HydrophobicContact CD2-CE1 3.55Å; F472-F554 AromaticContact CE2-CD1 3.86Å; F472-F554 HydrophobicContact CE2-CD1 3.86Å; F472-F554 HydrophobicContact CE2-CE1 4.08Å; F472-F554 HydrophobicContact CG-CE1 4.39Å; F472-V556 HydrophobicContact CB-CG1 4.41Å; F472-V556 HydrophobicContact CD1-CG1 3.56Å; F472-V556 HydrophobicContact CD1-CG2 4.34Å; F472-V556 HydrophobicContact CD2-CG1 4.39Å; F472-V556 HydrophobicContact CD2-CG2 4.25Å; F472-V556 HydrophobicContact CE1-CB 4.49Å; F472-V556 HydrophobicContact CE1-CG1 3.75Å; F472-V556 HydrophobicContact CE1-CG2 3.84Å; F472-V556 HydrophobicContact CE2-CG2 3.72Å; F472-V556 HydrophobicContact CG-CG1 3.9Å; F472-V556 HydrophobicContact CZ-CG1 4.23Å; F472-V556 HydrophobicContact CZ-CG2 3.49Å; F472-V556 VanDerWaalsContact CZ-CG2 3.49Å; F472-F560 HydrophobicContact CB-CB 4.48Å; F472-F560 HydrophobicContact CB-CD2 4.21Å; F472-F560 HydrophobicContact CB-CG 4.35Å; F472-F560 HydrophobicContact CD1-CB 4.49Å; F472-F560 AromaticContact CD1-CD1 3.67Å; F472-F560 HydrophobicContact CD1-CD1 3.67Å; F472-F560 AromaticContact CD1-CD2 3.75Å; F472-F560 HydrophobicContact CD1-CD2 3.75Å; F472-F560 AromaticContact CD1-CE1 3.69Å; F472-F560 HydrophobicContact CD1-CE1 3.69Å; F472-F560 AromaticContact CD1-CE2 3.75Å; F472-F560 HydrophobicContact CD1-CE2 3.75Å; F472-F560 AromaticContact CD1-CG 3.69Å; F472-F560 HydrophobicContact CD1-CG 3.69Å; F472-F560 AromaticContact CD1-CZ 3.71Å; F472-F560 HydrophobicContact CD1-CZ 3.71Å; F472-F560 HydrophobicContact CE1-CD1 4.07Å; F472-F560 AromaticContact CE1-CE1 3.77Å; F472-F560 HydrophobicContact CE1-CE1 3.77Å; F472-F560 HydrophobicContact CE1-CE2 4.45Å; F472-F560 AromaticContact CE1-CZ 3.96Å; F472-F560 HydrophobicContact CE1-CZ 3.96Å; F472-F560 HydrophobicContact CG-CD2 4.48Å; F472-F560 HydrophobicContact CG-CG 4.49Å
473	Y	97	Very high	95.7	Very high	34 Å²	34	34.3 Å²	34.3	13%	0.133	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-44.9	177.5	-58.8	-84.9	0	0	0	112.1	M470 F471 F554 P557 S598 I600 P601 F604	M470-Y473 PolarHBondContact O-N 3.3Å; F471-Y473 PolarHBondContact O-N 3.48Å; Y473-F554 AromaticContact CE2-CZ 3.8Å; Y473-F554 HydrophobicContact CE2-CZ 3.8Å; Y473-F554 WeakPolarHBondContact OH-CZ 3.45Å; Y473-P557 HydrophobicContact CE1-CG 3.67Å; Y473-P557 WeakPolarHBondContact OH-CG 3.41Å; Y473-S598 PolarHBondContact O-N 3.45Å; Y473-I600 HydrophobicContact CD2-CG2 4.29Å; Y473-P601 HydrophobicContact CD1-CG 4.14Å; Y473-P601 HydrophobicContact CE1-CG 3.46Å; Y473-P601 VanDerWaalsContact CE1-CG 3.46Å; Y473-P601 HydrophobicContact CE2-CG 4.24Å; Y473-P601 VanDerWaalsContact CZ-CD 3.49Å; Y473-F604 HydrophobicContact CD2-CE2 4.35Å; Y473-F604 HydrophobicContact CD2-CZ 4.44Å; Y473-F604 AromaticContact CE2-CE2 3.62Å; Y473-F604 HydrophobicContact CE2-CE2 3.62Å; Y473-F604 AromaticContact CE2-CZ 3.84Å; Y473-F604 HydrophobicContact CE2-CZ 3.84Å
474	T	96.6	Very high	95.7	Very high	10 Å²	10	36.6 Å²	36.6	6%	0.061	19%	0.191	C	C	.	.			trans	-138.3	131.7	-179	176.1	0	0	0	0	113.3	M470 F471 Y476 P477 F503 D597 I600	M470-T474 PolarHBondContact O-N 2.99Å; F471-T474 WeakPolarHBondContact CA-O 3.32Å; T474-Y476 PolarHBondContact OG1-N 2.95Å; T474-P477 HydrophobicContact CG2-CB 3.9Å; T474-P477 HydrophobicContact CG2-CG 4.33Å; T474-F503 WeakPolarHBondContact O-CE1 3.35Å; T474-D597 VanDerWaalsContact CA-OD2 3.31Å; T474-D597 WeakPolarHBondContact CA-OD2 3.44Å; T474-D597 WeakPolarHBondContact CB-OD2 3.5Å; T474-D597 PolarHBondContact OG1-OD2 3.15Å; T474-I600 HydrophobicContact CG2-CD1 3.51Å; T474-I600 HydrophobicContact CG2-CG1 3.78Å
475	R	97.3	Very high	95.6	Very high	6 Å²	6	34.5 Å²	34.5	2%	0.023	18%	0.179	C	C	.	.	S	Bend	trans	-98	-19.3	174.4	-62.9	151.9	-67.7	-154.4	-10.5	111.9	F471 P477 R507 Y510 V563 I593 L596 D597	F471-R475 HydrophobicContact CD2-CB 4.49Å; F471-R475 HydrophobicContact CD2-CG 4.13Å; F471-R475 HydrophobicContact CE1-CG 4.13Å; F471-R475 HydrophobicContact CE2-CB 3.93Å; F471-R475 HydrophobicContact CE2-CG 3.63Å; F471-R475 HydrophobicContact CZ-CB 4.34Å; F471-R475 HydrophobicContact CZ-CG 3.65Å; R475-P477 WeakPolarHBondContact O-CD 3.36Å; R475-R507 HydrophobicContact CB-CG 4.01Å; R475-R507 WeakPolarHBondContact O-CD 3.31Å; R475-R507 PolarHBondContact O-NE 3.5Å; R475-Y510 PolarHBondContact NH1-OH 3.37Å; R475-V563 VanDerWaalsContact CZ-CG1 3.47Å; R475-I593 PolarHBondContact NH2-O 2.84Å; R475-I593 VanDerWaalsContact NH2-O 3.13Å; R475-L596 PolarHBondContact NH2-O 3.02Å; R475-L596 VanDerWaalsContact NH2-O 3.09Å; R475-D597 IonicContact CZ-OD1 2.6Å; R475-D597 VanDerWaalsContact CZ-OD1 3.22Å; R475-D597 VanDerWaalsContact N-CG 3.32Å; R475-D597 PolarHBondContact N-OD1 2.87Å; R475-D597 VanDerWaalsContact N-OD1 3.13Å; R475-D597 PolarHBondContact N-OD2 3.23Å; R475-D597 IonicContact NE-OD1 2.76Å; R475-D597 PolarHBondContact NE-OD1 3.43Å; R475-D597 IonicContact NH2-OD1 3.83Å; R475-D597 PolarHBondContact NH2-OD1 3.26Å
476	Y	96.4	Very high	95.6	Very high	66 Å²	66	31.5 Å²	31.5	26%	0.259	17%	0.166	S	C	.	.	S	Bend	trans	-120.8	46	-177.4	-67.7	-100	0	0	0	113.1	T474 S478 Y511 I593 C594 D597	T474-Y476 PolarHBondContact OG1-N 2.95Å; Y476-S478 PolarHBondContact O-N 3.39Å; Y476-Y511 WeakPolarHBondContact CE2-OH 3.32Å; Y476-Y511 PolarHBondContact OH-OH 3.29Å; Y476-I593 HydrophobicContact CE2-CG2 4.2Å; Y476-C594 HydrophobicContact CD2-CB 4.14Å; Y476-C594 HydrophobicContact CE2-CB 4.18Å; Y476-C594 HydrophobicContact CG-CB 4.36Å; Y476-D597 PolarHBondContact N-OD2 3.01Å
477	P	96.4	Very high	95.4	Very high	17 Å²	17	35 Å²	35	11%	0.11	19%	0.19	C	C	.	.			trans	-62.4	133.7	-178.5	27.1	-35.1	0	0	0	111.5	T474 R475 V481 L482 F503	T474-P477 HydrophobicContact CG2-CB 3.9Å; T474-P477 HydrophobicContact CG2-CG 4.33Å; R475-P477 WeakPolarHBondContact O-CD 3.36Å; P477-V481 HydrophobicContact CB-CB 4.27Å; P477-V481 HydrophobicContact CB-CG1 3.93Å; P477-L482 HydrophobicContact CB-CD2 4.24Å; P477-L482 HydrophobicContact CB-CG 4.33Å; P477-L482 HydrophobicContact CG-CD2 4.18Å; P477-F503 HydrophobicContact CG-CB 4.41Å; P477-F503 HydrophobicContact CG-CD1 3.54Å; P477-F503 HydrophobicContact CG-CD2 3.84Å; P477-F503 HydrophobicContact CG-CE1 3.66Å; P477-F503 HydrophobicContact CG-CE2 3.95Å; P477-F503 HydrophobicContact CG-CG 3.65Å; P477-F503 HydrophobicContact CG-CZ 3.86Å
478	S	94.5	Very high	95.1	Very high	61 Å²	61	38 Å²	38	43%	0.427	21%	0.207	S	C	.	.			trans	-74.4	161.2	175.3	77.5	0	0	0	0	111.7	Y476 N480 V481 L482	Y476-S478 PolarHBondContact O-N 3.39Å; S478-N480 PolarHBondContact O-N 3.04Å; S478-N480 PolarHBondContact OG-N 3.39Å; S478-V481 PolarHBondContact O-N 3.09Å; S478-V481 PolarHBondContact OG-N 3.11Å; S478-L482 PolarHBondContact O-N 3.29Å
479	S	93.1	Very high	94.9	Very high	50 Å²	50	36.4 Å²	36.4	35%	0.35	20%	0.2	S	C	.	.	H	α-helix	trans	-57.8	-19.9	173.2	-50.2	0	0	0	0	113.8	K483	S479-K483 WeakPolarHBondContact O-CD 3.19Å; S479-K483 VanDerWaalsContact O-CG 3.29Å; S479-K483 WeakPolarHBondContact O-CG 3.41Å; S479-K483 PolarHBondContact O-N 3.22Å
480	N	93.6	Very high	94.7	Very high	113 Å²	113	45.2 Å²	45.2	60%	0.604	24%	0.239	S	C	*	.	H	α-helix	trans	-83.2	-42.3	174.5	-68.5	-3.7	0	0	0	111.1	S478 L482 K483 T484	S478-N480 PolarHBondContact O-N 3.04Å; S478-N480 PolarHBondContact OG-N 3.39Å; N480-L482 VanDerWaalsContact C-N 3.32Å; N480-L482 PolarHBondContact O-N 3.06Å; N480-K483 PolarHBondContact O-N 3.05Å; N480-K483 VanDerWaalsContact O-N 3.17Å; N480-T484 PolarHBondContact O-N 3.37Å; N480-T484 PolarHBondContact O-OG1 3.17Å; N480-T484 VanDerWaalsContact O-OG1 3.09Å
481	V	94.6	Very high	94.5	Very high	45 Å²	45	47.7 Å²	47.7	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-56.9	-48.3	171.6	172.1	0	0	0	0	110	P477 S478 K483 T484 F485 I600	P477-V481 HydrophobicContact CB-CB 4.27Å; P477-V481 HydrophobicContact CB-CG1 3.93Å; S478-V481 PolarHBondContact O-N 3.09Å; S478-V481 PolarHBondContact OG-N 3.11Å; V481-K483 VanDerWaalsContact C-N 3.3Å; V481-K483 PolarHBondContact O-N 3.45Å; V481-T484 PolarHBondContact O-N 2.95Å; V481-F485 HydrophobicContact CG1-CD2 3.84Å; V481-F485 HydrophobicContact CG1-CE2 4.14Å; V481-F485 WeakPolarHBondContact O-CD2 3.34Å; V481-F485 PolarHBondContact O-N 3Å; V481-F485 VanDerWaalsContact O-N 3.11Å; V481-I600 HydrophobicContact CG1-CD1 3.73Å
482	L	95.4	Very high	94.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-56.5	-42.2	176.8	-66.7	172.5	0	0	0	112.2	P477 S478 N480 T484 F486 F491 L499 I500 F503	P477-L482 HydrophobicContact CB-CD2 4.24Å; P477-L482 HydrophobicContact CB-CG 4.33Å; P477-L482 HydrophobicContact CG-CD2 4.18Å; S478-L482 PolarHBondContact O-N 3.29Å; N480-L482 VanDerWaalsContact C-N 3.32Å; N480-L482 PolarHBondContact O-N 3.06Å; L482-T484 VanDerWaalsContact C-N 3.34Å; L482-T484 PolarHBondContact O-N 2.58Å; L482-F486 HydrophobicContact CD2-CD2 4.46Å; L482-F486 HydrophobicContact CD2-CE2 4.12Å; L482-F486 WeakPolarHBondContact O-CD2 2.85Å; L482-F486 PolarHBondContact O-N 2.86Å; L482-F491 VanDerWaalsContact C-CZ 3.44Å; L482-F491 HydrophobicContact CB-CE1 3.99Å; L482-F491 HydrophobicContact CB-CZ 4.02Å; L482-F491 VanDerWaalsContact O-CZ 3.26Å; L482-F491 WeakPolarHBondContact O-CZ 3.43Å; L482-L499 HydrophobicContact CD1-CB 3.92Å; L482-L499 HydrophobicContact CD2-CB 4.4Å; L482-I500 HydrophobicContact CD1-CG1 4.22Å; L482-F503 HydrophobicContact CD2-CD2 4.16Å; L482-F503 HydrophobicContact CD2-CE2 3.76Å
483	K	92.9	Very high	94	Very high	108 Å²	108	60.5 Å²	60.5	47%	0.47	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-35.8	175.8	-76.4	170.6	179	-177.5	0	113.7	S479 N480 V481 F491	S479-K483 WeakPolarHBondContact O-CD 3.19Å; S479-K483 VanDerWaalsContact O-CG 3.29Å; S479-K483 WeakPolarHBondContact O-CG 3.41Å; S479-K483 PolarHBondContact O-N 3.22Å; N480-K483 PolarHBondContact O-N 3.05Å; N480-K483 VanDerWaalsContact O-N 3.17Å; V481-K483 VanDerWaalsContact C-N 3.3Å; V481-K483 PolarHBondContact O-N 3.45Å; K483-F491 HydrophobicContact CB-CD2 4.43Å; K483-F491 HydrophobicContact CB-CE2 4.36Å; K483-F491 HydrophobicContact CG-CB 4.34Å; K483-F491 HydrophobicContact CG-CD1 3.87Å; K483-F491 HydrophobicContact CG-CD2 3.74Å; K483-F491 HydrophobicContact CG-CE1 4.1Å; K483-F491 HydrophobicContact CG-CE2 4.01Å; K483-F491 HydrophobicContact CG-CG 3.7Å; K483-F491 HydrophobicContact CG-CZ 4.19Å
484	T	94.2	Very high	93.8	Very high	71 Å²	71	62.5 Å²	62.5	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-72.1	-36.7	-179.5	-55.4	0	0	0	0	112.7	N480 V481 L482 K605	N480-T484 PolarHBondContact O-N 3.37Å; N480-T484 PolarHBondContact O-OG1 3.17Å; N480-T484 VanDerWaalsContact O-OG1 3.09Å; V481-T484 PolarHBondContact O-N 2.95Å; L482-T484 VanDerWaalsContact C-N 3.34Å; L482-T484 PolarHBondContact O-N 2.58Å; T484-K605 HydrophobicContact CG2-CD 3.97Å; T484-K605 HydrophobicContact CG2-CG 4.47Å
485	F	94.1	Very high	93.6	Very high	16 Å²	16	62.3 Å²	62.3	7%	0.07	32%	0.319	C	S	.	.	H	α-helix	trans	-96.8	-3.5	-174.4	-70.2	-83.1	0	0	0	114.5	K466 M470 V481 P487 I600 F604 K605	K466-F485 WeakPolarHBondContact CE-O 3.41Å; K466-F485 PolarHBondContact NZ-O 2.97Å; M470-F485 HydrophobicContact CE-CB 3.51Å; M470-F485 HydrophobicContact CE-CD2 4.42Å; M470-F485 HydrophobicContact CE-CG 4.05Å; M470-F485 HydrophobicContact SD-CB 4.21Å; V481-F485 HydrophobicContact CG1-CD2 3.84Å; V481-F485 HydrophobicContact CG1-CE2 4.14Å; V481-F485 WeakPolarHBondContact O-CD2 3.34Å; V481-F485 PolarHBondContact O-N 3Å; V481-F485 VanDerWaalsContact O-N 3.11Å; F485-P487 VanDerWaalsContact C-CD 3.48Å; F485-I600 HydrophobicContact CD1-CB 4.34Å; F485-I600 HydrophobicContact CD1-CG2 4.17Å; F485-I600 HydrophobicContact CD2-CD1 3.9Å; F485-I600 HydrophobicContact CE1-CB 3.8Å; F485-I600 HydrophobicContact CE1-CG2 3.96Å; F485-I600 HydrophobicContact CE2-CB 4.07Å; F485-I600 HydrophobicContact CE2-CD1 4.03Å; F485-I600 HydrophobicContact CE2-CG1 4.33Å; F485-I600 HydrophobicContact CG-CD1 4.26Å; F485-I600 HydrophobicContact CZ-CB 3.66Å; F485-I600 HydrophobicContact CZ-CD1 4.46Å; F485-I600 HydrophobicContact CZ-CG1 4.41Å; F485-I600 HydrophobicContact CZ-CG2 4.34Å; F485-I600 WeakPolarHBondContact CZ-O 3.21Å; F485-F604 HydrophobicContact CD1-CB 3.68Å; F485-F604 HydrophobicContact CE1-CB 4.12Å; F485-K605 HydrophobicContact CD1-CB 4.48Å; F485-K605 HydrophobicContact CD1-CG 3.5Å; F485-K605 VanDerWaalsContact CD1-CG 3.5Å; F485-K605 HydrophobicContact CE1-CD 4.18Å; F485-K605 HydrophobicContact CE1-CG 3.42Å; F485-K605 VanDerWaalsContact CE1-CG 3.42Å; F485-K605 HydrophobicContact CG-CG 4.3Å; F485-K605 HydrophobicContact CZ-CD 4.49Å; F485-K605 VanDerWaalsContact CZ-CE 3.48Å; F485-K605 HydrophobicContact CZ-CG 4.15Å
486	F	93.6	Very high	93.5	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.326	C	S	.	.			trans	-126.6	62.6	171.1	-64.2	-81.1	0	0	0	111.3	H463 K466 A467 M470 L482 D488 V489 F491 L499	H463-F486 HydrophobicContact CB-CD1 4.31Å; H463-F486 HydrophobicContact CB-CE1 4.05Å; K466-F486 HydrophobicContact CB-CE1 4.07Å; K466-F486 HydrophobicContact CB-CZ 4.48Å; K466-F486 HydrophobicContact CD-CD1 4.29Å; K466-F486 HydrophobicContact CD-CE1 3.88Å; K466-F486 HydrophobicContact CG-CE1 3.92Å; K466-F486 HydrophobicContact CG-CZ 4.24Å; A467-F486 HydrophobicContact CB-CZ 3.92Å; M470-F486 HydrophobicContact CE-CE2 3.85Å; M470-F486 HydrophobicContact CE-CZ 4.47Å; M470-F486 HydrophobicContact SD-CE2 3.51Å; M470-F486 VanDerWaalsContact SD-CE2 3.51Å; M470-F486 HydrophobicContact SD-CZ 3.52Å; M470-F486 VanDerWaalsContact SD-CZ 3.52Å; L482-F486 HydrophobicContact CD2-CD2 4.46Å; L482-F486 HydrophobicContact CD2-CE2 4.12Å; L482-F486 WeakPolarHBondContact O-CD2 2.85Å; L482-F486 PolarHBondContact O-N 2.86Å; F486-D488 VanDerWaalsContact C-OD1 3.3Å; F486-D488 PolarHBondContact O-N 3.43Å; F486-V489 HydrophobicContact CB-CB 3.95Å; F486-V489 HydrophobicContact CB-CG2 3.8Å; F486-V489 HydrophobicContact CD1-CG2 4.36Å; F486-V489 HydrophobicContact CG-CG2 4.43Å; F486-V489 WeakPolarHBondContact O-CB 3.48Å; F486-V489 PolarHBondContact O-N 3.42Å; F486-V489 VanDerWaalsContact O-N 3.07Å; F486-F491 HydrophobicContact CB-CE2 3.99Å; F486-F491 HydrophobicContact CB-CZ 4.11Å; F486-F491 WeakPolarHBondContact O-CE2 3.3Å; F486-L499 HydrophobicContact CD2-CD2 4.47Å; F486-L499 HydrophobicContact CE2-CD2 4.14Å; F486-L499 HydrophobicContact CZ-CD2 4.34Å
487	P	92.1	Very high	93.3	Very high	83 Å²	83	63 Å²	63	54%	0.539	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.6	-173	30.3	-37.2	0	0	0	114.2	F485 K605	F485-P487 VanDerWaalsContact C-CD 3.48Å; P487-K605 WeakPolarHBondContact CG-O 3.49Å
488	D	90.3	Very high	93.3	Very high	64 Å²	64	64.2 Å²	64.2	34%	0.342	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-23.8	171.6	36.3	25.4	0	0	0	113.3	F486 S607	F486-D488 VanDerWaalsContact C-OD1 3.3Å; F486-D488 PolarHBondContact O-N 3.43Å; D488-S607 WeakPolarHBondContact OD2-CB 3.26Å; D488-S607 PolarHBondContact OD2-OG 3.49Å
489	V	92.8	Very high	93.4	Very high	10 Å²	10	61.3 Å²	61.3	6%	0.061	32%	0.317	C	S	.	.	S	Bend	trans	-82.1	120.5	-177.1	174.1	0	0	0	0	111.3	L459 H463 F486 F491 I495	L459-V489 HydrophobicContact CD2-CG1 4.09Å; L459-V489 HydrophobicContact CD2-CG2 4.01Å; H463-V489 WeakPolarHBondContact CE1-CG2 3.29Å; H463-V489 VanDerWaalsContact ND1-CG2 3.31Å; H463-V489 WeakPolarHBondContact ND1-CG2 3.12Å; F486-V489 HydrophobicContact CB-CB 3.95Å; F486-V489 HydrophobicContact CB-CG2 3.8Å; F486-V489 HydrophobicContact CD1-CG2 4.36Å; F486-V489 HydrophobicContact CG-CG2 4.43Å; F486-V489 WeakPolarHBondContact O-CB 3.48Å; F486-V489 PolarHBondContact O-N 3.42Å; F486-V489 VanDerWaalsContact O-N 3.07Å; V489-F491 HydrophobicContact CB-CD2 4.25Å; V489-F491 HydrophobicContact CB-CE2 3.89Å; V489-F491 HydrophobicContact CG1-CD2 4.05Å; V489-F491 HydrophobicContact CG1-CE2 3.91Å; V489-F491 HydrophobicContact CG1-CZ 4.31Å; V489-F491 WeakPolarHBondContact O-CD2 3.49Å; V489-F491 PolarHBondContact O-N 3.1Å; V489-I495 HydrophobicContact CG1-CG2 3.38Å
490	K	91.6	Very high	93.4	Very high	186 Å²	186	62.3 Å²	62.3	81%	0.809	32%	0.317	S	S	*	.			trans	-74.3	84.5	173	-68.2	177.9	-177.7	170.9	0	110.9	N492 I495	K490-N492 PolarHBondContact O-N 3.1Å; K490-I495 WeakPolarHBondContact O-CD1 3.4Å
491	F	93.2	Very high	93.6	Very high	51 Å²	51	62.6 Å²	62.6	22%	0.224	31%	0.313	C	S	.	.			trans	-55.8	100	-176	-84.3	-93.5	0	0	0	114.4	L482 K483 F486 V489 L499	L482-F491 VanDerWaalsContact C-CZ 3.44Å; L482-F491 HydrophobicContact CB-CE1 3.99Å; L482-F491 HydrophobicContact CB-CZ 4.02Å; L482-F491 VanDerWaalsContact O-CZ 3.26Å; L482-F491 WeakPolarHBondContact O-CZ 3.43Å; K483-F491 HydrophobicContact CB-CD2 4.43Å; K483-F491 HydrophobicContact CB-CE2 4.36Å; K483-F491 HydrophobicContact CG-CB 4.34Å; K483-F491 HydrophobicContact CG-CD1 3.87Å; K483-F491 HydrophobicContact CG-CD2 3.74Å; K483-F491 HydrophobicContact CG-CE1 4.1Å; K483-F491 HydrophobicContact CG-CE2 4.01Å; K483-F491 HydrophobicContact CG-CG 3.7Å; K483-F491 HydrophobicContact CG-CZ 4.19Å; F486-F491 HydrophobicContact CB-CE2 3.99Å; F486-F491 HydrophobicContact CB-CZ 4.11Å; F486-F491 WeakPolarHBondContact O-CE2 3.3Å; V489-F491 HydrophobicContact CB-CD2 4.25Å; V489-F491 HydrophobicContact CB-CE2 3.89Å; V489-F491 HydrophobicContact CG1-CD2 4.05Å; V489-F491 HydrophobicContact CG1-CE2 3.91Å; V489-F491 HydrophobicContact CG1-CZ 4.31Å; V489-F491 WeakPolarHBondContact O-CD2 3.49Å; V489-F491 PolarHBondContact O-N 3.1Å; F491-L499 HydrophobicContact CE1-CD1 3.44Å; F491-L499 VanDerWaalsContact CE1-CD1 3.44Å; F491-L499 HydrophobicContact CZ-CD1 3.57Å
492	N	92.3	Very high	93.7	Very high	61 Å²	61	62 Å²	62	33%	0.326	31%	0.306	S	S	.	.			trans	-105.2	175.3	165.8	74	40.7	0	0	0	111.3	K490 C494 I495 T496	K490-N492 PolarHBondContact O-N 3.1Å; N492-C494 VanDerWaalsContact C-N 3.32Å; N492-C494 PolarHBondContact O-N 2.98Å; N492-C494 WeakPolarHBondContact OD1-CA 3.2Å; N492-C494 WeakPolarHBondContact OD1-CB 3.43Å; N492-C494 PolarHBondContact OD1-N 3.05Å; N492-I495 WeakPolarHBondContact ND2-CD1 3.48Å; N492-I495 PolarHBondContact O-N 3.14Å; N492-I495 PolarHBondContact OD1-N 3.04Å; N492-T496 WeakPolarHBondContact O-CB 3.5Å; N492-T496 PolarHBondContact O-N 3.13Å; N492-T496 PolarHBondContact O-OG1 3.36Å
493	R	91.8	Very high	93.8	Very high	218 Å²	218	62.2 Å²	62.2	82%	0.823	31%	0.307	S	S	*	.	H	α-helix	trans	-60.6	-38	-178.3	-176.6	-177.1	-72.1	171.8	-1.8	112.8	S497	R493-S497 WeakPolarHBondContact O-CB 3.48Å; R493-S497 PolarHBondContact O-N 3.12Å; R493-S497 VanDerWaalsContact O-N 3.08Å; R493-S497 PolarHBondContact O-OG 3.44Å
494	C	92.7	Very high	94.1	Very high	76 Å²	76	59.4 Å²	59.4	51%	0.514	30%	0.301	S	S	.	.	H	α-helix	trans	-70.2	-49.5	-179	-56.8	0	0	0	0	110.6	N492 T496 S497 Q498	N492-C494 VanDerWaalsContact C-N 3.32Å; N492-C494 PolarHBondContact O-N 2.98Å; N492-C494 WeakPolarHBondContact OD1-CA 3.2Å; N492-C494 WeakPolarHBondContact OD1-CB 3.43Å; N492-C494 PolarHBondContact OD1-N 3.05Å; C494-T496 PolarHBondContact O-N 3.21Å; C494-S497 CarbonylContact O-C 3.56Å; C494-S497 WeakPolarHBondContact O-CB 3.18Å; C494-S497 PolarHBondContact O-N 2.83Å; C494-Q498 WeakPolarHBondContact O-CB 3.49Å; C494-Q498 PolarHBondContact O-N 3.36Å
495	I	93.8	Very high	94.2	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-45.6	176.9	-73	173.8	0	0	0	111.6	L459 V489 K490 N492 S497 Q498 L499	L459-I495 HydrophobicContact CD1-CG2 4.18Å; L459-I495 HydrophobicContact CD2-CG2 4.19Å; L459-I495 HydrophobicContact CG-CG1 4.45Å; L459-I495 HydrophobicContact CG-CG2 4.09Å; V489-I495 HydrophobicContact CG1-CG2 3.38Å; K490-I495 WeakPolarHBondContact O-CD1 3.4Å; N492-I495 WeakPolarHBondContact ND2-CD1 3.48Å; N492-I495 PolarHBondContact O-N 3.14Å; N492-I495 PolarHBondContact OD1-N 3.04Å; I495-S497 VanDerWaalsContact C-N 3.33Å; I495-S497 PolarHBondContact O-N 2.87Å; I495-Q498 WeakPolarHBondContact O-CB 3.35Å; I495-Q498 PolarHBondContact O-N 3.03Å; I495-Q498 VanDerWaalsContact O-N 3.07Å; I495-L499 HydrophobicContact CG2-CD1 4.36Å; I495-L499 PolarHBondContact O-N 3.06Å
496	T	93.8	Very high	94.5	Very high	27 Å²	27	59.3 Å²	59.3	17%	0.166	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-45.4	176.1	-50.2	0	0	0	0	110.7	N492 C494 Q498 I500	N492-T496 WeakPolarHBondContact O-CB 3.5Å; N492-T496 PolarHBondContact O-N 3.13Å; N492-T496 PolarHBondContact O-OG1 3.36Å; C494-T496 PolarHBondContact O-N 3.21Å; T496-Q498 VanDerWaalsContact C-N 3.29Å; T496-Q498 PolarHBondContact O-N 2.83Å; T496-I500 HydrophobicContact CG2-CD1 4.06Å; T496-I500 VanDerWaalsContact O-CG1 3.29Å; T496-I500 WeakPolarHBondContact O-CG1 3.29Å; T496-I500 PolarHBondContact O-N 3.38Å; T496-I500 VanDerWaalsContact O-N 3.12Å
497	S	93.7	Very high	94.7	Very high	58 Å²	58	61.5 Å²	61.5	41%	0.406	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-33.8	174.8	-55.7	0	0	0	0	112.6	R493 C494 I495 K501	R493-S497 WeakPolarHBondContact O-CB 3.48Å; R493-S497 PolarHBondContact O-N 3.12Å; R493-S497 VanDerWaalsContact O-N 3.08Å; R493-S497 PolarHBondContact O-OG 3.44Å; C494-S497 CarbonylContact O-C 3.56Å; C494-S497 WeakPolarHBondContact O-CB 3.18Å; C494-S497 PolarHBondContact O-N 2.83Å; I495-S497 VanDerWaalsContact C-N 3.33Å; I495-S497 PolarHBondContact O-N 2.87Å; S497-K501 WeakPolarHBondContact O-CB 3.44Å; S497-K501 VanDerWaalsContact O-CG 3.31Å; S497-K501 WeakPolarHBondContact O-CG 3.47Å; S497-K501 PolarHBondContact O-N 3.35Å
498	Q	94.7	Very high	95	Very high	43 Å²	43	62.8 Å²	62.8	20%	0.201	31%	0.305	C	S	.	.	H	α-helix	trans	-71.1	-43.6	-179.2	-171.7	57.2	47.1	0	0	112.2	L459 C494 I495 T496 K501 W502	L459-Q498 HydrophobicContact CD1-CB 3.72Å; L459-Q498 HydrophobicContact CD1-CG 3.63Å; C494-Q498 WeakPolarHBondContact O-CB 3.49Å; C494-Q498 PolarHBondContact O-N 3.36Å; I495-Q498 WeakPolarHBondContact O-CB 3.35Å; I495-Q498 PolarHBondContact O-N 3.03Å; I495-Q498 VanDerWaalsContact O-N 3.07Å; T496-Q498 VanDerWaalsContact C-N 3.29Å; T496-Q498 PolarHBondContact O-N 2.83Å; Q498-K501 PolarHBondContact O-N 3.34Å; Q498-W502 HydrophobicContact CG-CZ2 4.47Å; Q498-W502 VanDerWaalsContact NE2-CD1 3.34Å; Q498-W502 PolarHBondContact O-N 3.45Å
499	L	96.3	Very high	95.4	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-43.4	172.1	-71.9	163.2	0	0	0	111.3	L459 L482 F486 F491 I495 K501 W502 F503	L459-L499 HydrophobicContact CD1-CD2 4.49Å; L459-L499 HydrophobicContact CD1-CG 4.13Å; L459-L499 HydrophobicContact CD2-CD1 4.34Å; L459-L499 HydrophobicContact CD2-CD2 4.07Å; L459-L499 HydrophobicContact CD2-CG 4.17Å; L482-L499 HydrophobicContact CD1-CB 3.92Å; L482-L499 HydrophobicContact CD2-CB 4.4Å; F486-L499 HydrophobicContact CD2-CD2 4.47Å; F486-L499 HydrophobicContact CE2-CD2 4.14Å; F486-L499 HydrophobicContact CZ-CD2 4.34Å; F491-L499 HydrophobicContact CE1-CD1 3.44Å; F491-L499 VanDerWaalsContact CE1-CD1 3.44Å; F491-L499 HydrophobicContact CZ-CD1 3.57Å; I495-L499 HydrophobicContact CG2-CD1 4.36Å; I495-L499 PolarHBondContact O-N 3.06Å; L499-K501 VanDerWaalsContact C-N 3.34Å; L499-K501 PolarHBondContact O-N 3.17Å; L499-W502 HydrophobicContact CD2-CE3 3.71Å; L499-W502 HydrophobicContact CD2-CZ3 3.76Å; L499-W502 WeakPolarHBondContact O-CB 3.16Å; L499-W502 PolarHBondContact O-N 3.39Å; L499-F503 WeakPolarHBondContact O-CD2 3.42Å; L499-F503 PolarHBondContact O-N 3.27Å
500	I	94.9	Very high	95.7	Very high	71 Å²	71	61.5 Å²	61.5	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-37.4	176.5	-67.9	168.2	0	0	0	111.5	L482 T496 S504	L482-I500 HydrophobicContact CD1-CG1 4.22Å; T496-I500 HydrophobicContact CG2-CD1 4.06Å; T496-I500 VanDerWaalsContact O-CG1 3.29Å; T496-I500 WeakPolarHBondContact O-CG1 3.29Å; T496-I500 PolarHBondContact O-N 3.38Å; T496-I500 VanDerWaalsContact O-N 3.12Å; I500-S504 WeakPolarHBondContact O-CB 3.49Å; I500-S504 PolarHBondContact O-N 3.07Å; I500-S504 PolarHBondContact O-OG 3.48Å
501	K	96	Very high	96	Very high	120 Å²	120	53.3 Å²	53.3	52%	0.522	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-44.6	171.8	-77.9	-177.6	-58.6	173	0	111.8	S497 Q498 L499 S504 N505	S497-K501 WeakPolarHBondContact O-CB 3.44Å; S497-K501 VanDerWaalsContact O-CG 3.31Å; S497-K501 WeakPolarHBondContact O-CG 3.47Å; S497-K501 PolarHBondContact O-N 3.35Å; Q498-K501 PolarHBondContact O-N 3.34Å; L499-K501 VanDerWaalsContact C-N 3.34Å; L499-K501 PolarHBondContact O-N 3.17Å; K501-S504 WeakPolarHBondContact O-CB 3.49Å; K501-S504 PolarHBondContact O-N 3.42Å; K501-S504 VanDerWaalsContact O-N 3.13Å; K501-N505 PolarHBondContact O-N 3.21Å
502	W	98	Very high	96.2	Very high	33 Å²	33	55.5 Å²	55.5	13%	0.125	27%	0.273	C	S	.	.	H	α-helix	trans	-56.5	-54.6	175.5	-69.2	-14.7	0	0	0	111.7	L459 H463 L464 A467 Q498 L499 S504 N505 F506	L459-W502 HydrophobicContact CB-CH2 3.91Å; L459-W502 HydrophobicContact CB-CZ2 4.35Å; L459-W502 HydrophobicContact CD1-CH2 4.04Å; L459-W502 HydrophobicContact CD1-CZ2 4.27Å; L459-W502 HydrophobicContact CD1-CZ3 4.39Å; L459-W502 HydrophobicContact CD2-CH2 4.35Å; L459-W502 HydrophobicContact CD2-CZ3 4.42Å; L459-W502 HydrophobicContact CG-CH2 4.33Å; H463-W502 HydrophobicContact CB-CH2 4.45Å; H463-W502 HydrophobicContact CB-CZ3 4.36Å; L464-W502 HydrophobicContact CB-CH2 3.79Å; L464-W502 HydrophobicContact CB-CZ2 4.15Å; L464-W502 HydrophobicContact CB-CZ3 4.03Å; L464-W502 HydrophobicContact CD1-CD2 3.65Å; L464-W502 HydrophobicContact CD1-CE3 3.86Å; L464-W502 HydrophobicContact CD1-CG 4.07Å; L464-W502 HydrophobicContact CD1-CH2 4.26Å; L464-W502 HydrophobicContact CD1-CZ2 4.07Å; L464-W502 HydrophobicContact CD1-CZ3 4.16Å; A467-W502 HydrophobicContact CB-CE3 3.97Å; A467-W502 HydrophobicContact CB-CZ3 4.32Å; Q498-W502 HydrophobicContact CG-CZ2 4.47Å; Q498-W502 VanDerWaalsContact NE2-CD1 3.34Å; Q498-W502 PolarHBondContact O-N 3.45Å; L499-W502 HydrophobicContact CD2-CE3 3.71Å; L499-W502 HydrophobicContact CD2-CZ3 3.76Å; L499-W502 WeakPolarHBondContact O-CB 3.16Å; L499-W502 PolarHBondContact O-N 3.39Å; W502-S504 PolarHBondContact O-N 3.12Å; W502-S504 VanDerWaalsContact O-N 3.14Å; W502-N505 PolarHBondContact O-N 3.44Å; W502-N505 VanDerWaalsContact O-N 3.1Å; W502-F506 HydrophobicContact CB-CE1 4.19Å; W502-F506 HydrophobicContact CB-CE2 4.16Å; W502-F506 HydrophobicContact CB-CZ 3.79Å; W502-F506 HydrophobicContact CG-CZ 4.49Å; W502-F506 WeakPolarHBondContact O-CD1 3.1Å; W502-F506 WeakPolarHBondContact O-CG 3.24Å; W502-F506 PolarHBondContact O-N 3.04Å
503	F	98.2	Very high	96.5	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-20	177.1	-82.7	-84.7	0	0	0	114.1	A467 M470 F471 T474 P477 L482 L499 F506 R507	A467-F503 HydrophobicContact CB-CE2 3.96Å; A467-F503 HydrophobicContact CB-CZ 4.27Å; A467-F503 VanDerWaalsContact O-CZ 3.28Å; A467-F503 WeakPolarHBondContact O-CZ 3.31Å; M470-F503 HydrophobicContact CB-CZ 4.09Å; F471-F503 HydrophobicContact CB-CE1 4.44Å; F471-F503 HydrophobicContact CD2-CD1 4Å; F471-F503 HydrophobicContact CD2-CE1 4.19Å; T474-F503 WeakPolarHBondContact O-CE1 3.35Å; P477-F503 HydrophobicContact CG-CB 4.41Å; P477-F503 HydrophobicContact CG-CD1 3.54Å; P477-F503 HydrophobicContact CG-CD2 3.84Å; P477-F503 HydrophobicContact CG-CE1 3.66Å; P477-F503 HydrophobicContact CG-CE2 3.95Å; P477-F503 HydrophobicContact CG-CG 3.65Å; P477-F503 HydrophobicContact CG-CZ 3.86Å; L482-F503 HydrophobicContact CD2-CD2 4.16Å; L482-F503 HydrophobicContact CD2-CE2 3.76Å; L499-F503 WeakPolarHBondContact O-CD2 3.42Å; L499-F503 PolarHBondContact O-N 3.27Å; F503-F506 HydrophobicContact CD1-CD2 4.01Å; F503-F506 HydrophobicContact CE1-CD2 4.26Å; F503-F506 HydrophobicContact CG-CD2 4.2Å; F503-R507 WeakPolarHBondContact O-CG 3.38Å; F503-R507 PolarHBondContact O-N 2.83Å; F503-R507 PolarHBondContact O-NE 3.44Å
504	S	97.6	Very high	96.9	Very high	49 Å²	49	43.5 Å²	43.5	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-75.6	-44.9	171.6	-56.2	0	0	0	0	111.9	I500 K501 W502 R507 E508	I500-S504 WeakPolarHBondContact O-CB 3.49Å; I500-S504 PolarHBondContact O-N 3.07Å; I500-S504 PolarHBondContact O-OG 3.48Å; K501-S504 WeakPolarHBondContact O-CB 3.49Å; K501-S504 PolarHBondContact O-N 3.42Å; K501-S504 VanDerWaalsContact O-N 3.13Å; W502-S504 PolarHBondContact O-N 3.12Å; W502-S504 VanDerWaalsContact O-N 3.14Å; S504-R507 PolarHBondContact O-N 3.25Å; S504-R507 PolarHBondContact OG-NH2 2.82Å; S504-E508 WeakPolarHBondContact O-CB 3.44Å; S504-E508 PolarHBondContact O-N 3.1Å
505	N	97.8	Very high	97.1	Very high	81 Å²	81	41.8 Å²	41.8	43%	0.433	21%	0.209	S	C	.	.	H	α-helix	trans	-69.3	-31.1	175.1	178.7	-115.6	0	0	0	112.8	K501 W502 E508 F509	K501-N505 PolarHBondContact O-N 3.21Å; W502-N505 PolarHBondContact O-N 3.44Å; W502-N505 VanDerWaalsContact O-N 3.1Å; N505-E508 PolarHBondContact ND2-OE2 2.96Å; N505-E508 WeakPolarHBondContact O-CB 3.46Å; N505-E508 PolarHBondContact O-N 3.44Å; N505-F509 PolarHBondContact O-N 2.99Å
506	F	98.6	Very high	97.4	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-47.6	171.2	-58.7	-13.2	0	0	0	111	L464 A467 K468 F471 W502 F503 E508 F509 Y510 Y548	L464-F506 HydrophobicContact CD1-CE1 4.24Å; L464-F506 HydrophobicContact CD1-CZ 3.9Å; A467-F506 HydrophobicContact CB-CE2 4.02Å; A467-F506 HydrophobicContact CB-CZ 4.33Å; K468-F506 HydrophobicContact CB-CZ 4.41Å; K468-F506 HydrophobicContact CD-CE1 4.34Å; K468-F506 HydrophobicContact CD-CZ 4.49Å; K468-F506 HydrophobicContact CG-CD1 4.37Å; K468-F506 HydrophobicContact CG-CE1 3.64Å; K468-F506 HydrophobicContact CG-CE2 3.98Å; K468-F506 HydrophobicContact CG-CZ 3.41Å; K468-F506 VanDerWaalsContact CG-CZ 3.41Å; F471-F506 HydrophobicContact CB-CD2 4.37Å; F471-F506 HydrophobicContact CD2-CB 3.52Å; F471-F506 AromaticContact CD2-CD2 3.92Å; F471-F506 HydrophobicContact CD2-CD2 3.92Å; F471-F506 HydrophobicContact CD2-CG 4.21Å; F471-F506 HydrophobicContact CE2-CB 3.38Å; F471-F506 HydrophobicContact CG-CB 4.14Å; F471-F506 HydrophobicContact CG-CD2 4.35Å; F471-F506 HydrophobicContact CZ-CB 3.91Å; W502-F506 HydrophobicContact CB-CE1 4.19Å; W502-F506 HydrophobicContact CB-CE2 4.16Å; W502-F506 HydrophobicContact CB-CZ 3.79Å; W502-F506 HydrophobicContact CG-CZ 4.49Å; W502-F506 WeakPolarHBondContact O-CD1 3.1Å; W502-F506 WeakPolarHBondContact O-CG 3.24Å; W502-F506 PolarHBondContact O-N 3.04Å; F503-F506 HydrophobicContact CD1-CD2 4.01Å; F503-F506 HydrophobicContact CE1-CD2 4.26Å; F503-F506 HydrophobicContact CG-CD2 4.2Å; F506-E508 VanDerWaalsContact C-N 3.32Å; F506-E508 PolarHBondContact O-N 3.28Å; F506-F509 PolarHBondContact O-N 2.68Å; F506-Y510 WeakPolarHBondContact O-CB 3.49Å; F506-Y510 PolarHBondContact O-N 2.91Å; F506-Y548 HydrophobicContact CB-CE1 3.88Å; F506-Y548 HydrophobicContact CD1-CE1 4.39Å; F506-Y548 HydrophobicContact CG-CE1 4.11Å; F506-Y548 PolarHBondContact O-OH 3.5Å
507	R	98.3	Very high	97.6	Very high	46 Å²	46	46.1 Å²	46.1	17%	0.174	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-40.6	173.6	-80.9	174.2	-67.7	179.9	6.6	112.6	F471 R475 F503 S504 Y510 Y511	F471-R507 HydrophobicContact CE2-CG 3.96Å; F471-R507 HydrophobicContact CZ-CG 4.26Å; R475-R507 HydrophobicContact CB-CG 4.01Å; R475-R507 WeakPolarHBondContact O-CD 3.31Å; R475-R507 PolarHBondContact O-NE 3.5Å; F503-R507 WeakPolarHBondContact O-CG 3.38Å; F503-R507 PolarHBondContact O-N 2.83Å; F503-R507 PolarHBondContact O-NE 3.44Å; S504-R507 PolarHBondContact O-N 3.25Å; S504-R507 PolarHBondContact OG-NH2 2.82Å; R507-Y510 PolarHBondContact O-N 3.36Å; R507-Y511 HydrophobicContact CB-CD2 4.24Å; R507-Y511 HydrophobicContact CB-CE2 3.78Å; R507-Y511 HydrophobicContact CG-CE2 4.23Å; R507-Y511 WeakPolarHBondContact O-CB 3.47Å; R507-Y511 WeakPolarHBondContact O-CD2 3.46Å; R507-Y511 PolarHBondContact O-N 2.93Å
508	E	98.3	Very high	97.8	Very high	110 Å²	110	43.4 Å²	43.4	51%	0.514	21%	0.206	S	C	.	.	H	α-helix	trans	-58.3	-52.3	175.8	176.6	176.5	-125.5	0	0	111.7	S504 N505 F506 Y510 Y511 I512	S504-E508 WeakPolarHBondContact O-CB 3.44Å; S504-E508 PolarHBondContact O-N 3.1Å; N505-E508 PolarHBondContact ND2-OE2 2.96Å; N505-E508 WeakPolarHBondContact O-CB 3.46Å; N505-E508 PolarHBondContact O-N 3.44Å; F506-E508 VanDerWaalsContact C-N 3.32Å; F506-E508 PolarHBondContact O-N 3.28Å; E508-Y510 PolarHBondContact O-N 2.92Å; E508-Y511 PolarHBondContact O-N 3.1Å; E508-I512 HydrophobicContact CG-CD1 3.96Å; E508-I512 WeakPolarHBondContact O-CB 3.5Å; E508-I512 WeakPolarHBondContact O-CD1 3.38Å; E508-I512 VanDerWaalsContact O-CG1 3.24Å; E508-I512 WeakPolarHBondContact O-CG1 3.2Å; E508-I512 PolarHBondContact O-N 3.32Å
509	F	98.6	Very high	98	Very high	48 Å²	48	45.9 Å²	45.9	21%	0.211	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-46.1	175.3	179	-96.2	0	0	0	112.3	N505 F506 I512 Q513 L544 H547 Y548	N505-F509 PolarHBondContact O-N 2.99Å; F506-F509 PolarHBondContact O-N 2.68Å; F509-I512 PolarHBondContact O-N 3.38Å; F509-Q513 HydrophobicContact CD1-CG 4.28Å; F509-Q513 HydrophobicContact CE1-CG 3.76Å; F509-Q513 HydrophobicContact CE2-CG 4.31Å; F509-Q513 HydrophobicContact CZ-CG 3.78Å; F509-Q513 WeakPolarHBondContact O-CG 3.01Å; F509-Q513 PolarHBondContact O-N 3Å; F509-L544 HydrophobicContact CD1-CD2 4.5Å; F509-L544 HydrophobicContact CE1-CD2 4.18Å; F509-H547 HydrophobicContact CD1-CB 3.93Å; F509-H547 AromaticContact CD1-CD2 3.95Å; F509-H547 AromaticContact CD1-CG 3.53Å; F509-H547 AromaticContact CD1-ND1 3.57Å; F509-H547 AromaticContact CD2-CE1 3.89Å; F509-H547 AromaticContact CD2-ND1 3.57Å; F509-H547 HydrophobicContact CE1-CB 3.33Å; F509-H547 AromaticContact CE1-CG 3.43Å; F509-H547 VanDerWaalsContact CE1-CG 3.43Å; F509-H547 AromaticContact CE1-ND1 3.57Å; F509-H547 AromaticContact CE2-ND1 3.57Å; F509-H547 AromaticContact CG-CE1 3.73Å; F509-H547 AromaticContact CG-ND1 3.58Å; F509-H547 HydrophobicContact CZ-CB 3.72Å; F509-H547 AromaticContact CZ-CG 3.83Å; F509-H547 AromaticContact CZ-ND1 3.57Å; F509-Y548 HydrophobicContact CD1-CE2 4.39Å
510	Y	98.8	Very high	98	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.7	-50.7	177.3	-179.7	-99	0	0	0	111.7	F471 R475 F506 R507 E508 I512 Q513 M514 L544 F560 V563 T567	F471-Y510 AromaticContact CE1-CD2 3.81Å; F471-Y510 HydrophobicContact CE1-CD2 3.81Å; F471-Y510 AromaticContact CE1-CG 3.98Å; F471-Y510 HydrophobicContact CE1-CG 3.98Å; F471-Y510 HydrophobicContact CZ-CD2 4.37Å; F471-Y510 HydrophobicContact CZ-CG 4.07Å; R475-Y510 PolarHBondContact NH1-OH 3.37Å; F506-Y510 WeakPolarHBondContact O-CB 3.49Å; F506-Y510 PolarHBondContact O-N 2.91Å; R507-Y510 PolarHBondContact O-N 3.36Å; E508-Y510 PolarHBondContact O-N 2.92Å; Y510-I512 VanDerWaalsContact C-N 3.34Å; Y510-I512 PolarHBondContact O-N 2.71Å; Y510-Q513 PolarHBondContact O-N 2.92Å; Y510-M514 HydrophobicContact CD1-CG 4.34Å; Y510-M514 HydrophobicContact CD2-CE 4.04Å; Y510-M514 HydrophobicContact CE1-CE 4.23Å; Y510-M514 HydrophobicContact CE1-CG 4.25Å; Y510-M514 HydrophobicContact CE2-CE 3.44Å; Y510-M514 VanDerWaalsContact CE2-CE 3.44Å; Y510-M514 WeakPolarHBondContact O-CG 3.33Å; Y510-M514 PolarHBondContact O-N 3.47Å; Y510-L544 HydrophobicContact CD2-CD1 4.35Å; Y510-L544 HydrophobicContact CD2-CD2 3.93Å; Y510-L544 HydrophobicContact CE2-CD1 4.36Å; Y510-F560 HydrophobicContact CD2-CZ 4.41Å; Y510-F560 AromaticContact CE2-CE2 3.99Å; Y510-F560 HydrophobicContact CE2-CE2 3.99Å; Y510-F560 AromaticContact CE2-CZ 3.95Å; Y510-F560 HydrophobicContact CE2-CZ 3.95Å; Y510-V563 PolarHBondContact OH-O 2.8Å; Y510-T567 HydrophobicContact CE1-CG2 3.77Å; Y510-T567 PolarHBondContact OH-OG1 3.03Å
511	Y	98.5	Very high	98.2	Very high	13 Å²	13	46.9 Å²	46.9	5%	0.051	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-29.9	179.3	-61.2	-34.1	0	0	0	113.5	Y476 R507 E508 E515 F571 Y590 I593	Y476-Y511 WeakPolarHBondContact CE2-OH 3.32Å; Y476-Y511 PolarHBondContact OH-OH 3.29Å; R507-Y511 HydrophobicContact CB-CD2 4.24Å; R507-Y511 HydrophobicContact CB-CE2 3.78Å; R507-Y511 HydrophobicContact CG-CE2 4.23Å; R507-Y511 WeakPolarHBondContact O-CB 3.47Å; R507-Y511 WeakPolarHBondContact O-CD2 3.46Å; R507-Y511 PolarHBondContact O-N 2.93Å; E508-Y511 PolarHBondContact O-N 3.1Å; Y511-E515 WeakPolarHBondContact O-CB 3.2Å; Y511-E515 PolarHBondContact O-N 3.5Å; Y511-F571 AromaticContact CD1-CE2 3.96Å; Y511-F571 HydrophobicContact CD1-CE2 3.96Å; Y511-F571 HydrophobicContact CD1-CZ 4.01Å; Y511-F571 HydrophobicContact CG-CZ 4.2Å; Y511-Y590 HydrophobicContact CD1-CD1 4.48Å; Y511-Y590 AromaticContact CD1-CE1 3.98Å; Y511-Y590 HydrophobicContact CD1-CE1 3.98Å; Y511-Y590 HydrophobicContact CD2-CD1 4.11Å; Y511-Y590 AromaticContact CD2-CE1 3.28Å; Y511-Y590 HydrophobicContact CD2-CE1 3.28Å; Y511-Y590 AromaticContact CD2-CZ 3.6Å; Y511-Y590 HydrophobicContact CE1-CD1 4.07Å; Y511-Y590 AromaticContact CE1-CE1 4Å; Y511-Y590 HydrophobicContact CE1-CE1 4Å; Y511-Y590 AromaticContact CE2-CD1 3.6Å; Y511-Y590 HydrophobicContact CE2-CD1 3.6Å; Y511-Y590 AromaticContact CE2-CE1 3.24Å; Y511-Y590 HydrophobicContact CE2-CE1 3.24Å; Y511-Y590 HydrophobicContact CE2-CE2 4.46Å; Y511-Y590 HydrophobicContact CE2-CG 4.37Å; Y511-Y590 AromaticContact CE2-CZ 3.73Å; Y511-Y590 AromaticContact CG-CE1 3.68Å; Y511-Y590 HydrophobicContact CG-CE1 3.68Å; Y511-Y590 AromaticContact CZ-CD1 3.6Å; Y511-Y590 AromaticContact CZ-CE1 3.64Å; Y511-I593 HydrophobicContact CD1-CD1 4.33Å; Y511-I593 HydrophobicContact CE1-CD1 3.58Å; Y511-I593 HydrophobicContact CE1-CG2 4.24Å
512	I	98.4	Very high	98.2	Very high	98 Å²	98	44 Å²	44	50%	0.503	21%	0.208	S	C	.	.	H	α-helix	trans	-65.7	-42.3	171.5	-71.5	165	0	0	0	110.7	E508 F509 Y510 K516	E508-I512 HydrophobicContact CG-CD1 3.96Å; E508-I512 WeakPolarHBondContact O-CB 3.5Å; E508-I512 WeakPolarHBondContact O-CD1 3.38Å; E508-I512 VanDerWaalsContact O-CG1 3.24Å; E508-I512 WeakPolarHBondContact O-CG1 3.2Å; E508-I512 PolarHBondContact O-N 3.32Å; F509-I512 PolarHBondContact O-N 3.38Å; Y510-I512 VanDerWaalsContact C-N 3.34Å; Y510-I512 PolarHBondContact O-N 2.71Å; I512-K516 VanDerWaalsContact O-CB 3.3Å; I512-K516 WeakPolarHBondContact O-CB 3.37Å; I512-K516 PolarHBondContact O-N 2.87Å
513	Q	98.7	Very high	98.2	Very high	27 Å²	27	46.5 Å²	46.5	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-65	-46.4	174.2	-61.5	-45	-59.6	0	0	111.3	F509 Y510 E515 K516 F517 L540 L544	F509-Q513 HydrophobicContact CD1-CG 4.28Å; F509-Q513 HydrophobicContact CE1-CG 3.76Å; F509-Q513 HydrophobicContact CE2-CG 4.31Å; F509-Q513 HydrophobicContact CZ-CG 3.78Å; F509-Q513 WeakPolarHBondContact O-CG 3.01Å; F509-Q513 PolarHBondContact O-N 3Å; Y510-Q513 PolarHBondContact O-N 2.92Å; Q513-E515 VanDerWaalsContact C-N 3.33Å; Q513-E515 PolarHBondContact O-N 3.07Å; Q513-K516 WeakPolarHBondContact O-CB 3.28Å; Q513-K516 PolarHBondContact O-N 3.1Å; Q513-K516 VanDerWaalsContact O-N 3.13Å; Q513-F517 HydrophobicContact CB-CD2 4.48Å; Q513-F517 VanDerWaalsContact O-CD2 3.31Å; Q513-F517 WeakPolarHBondContact O-CD2 3.22Å; Q513-F517 PolarHBondContact O-N 2.82Å; Q513-L540 HydrophobicContact CB-CD1 3.79Å; Q513-L544 HydrophobicContact CB-CD2 4.09Å; Q513-L544 HydrophobicContact CG-CD2 4Å
514	M	98.5	Very high	98.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-40.7	-178.8	-64.9	-68.8	172.7	0	0	112.3	Y510 A518 L540 L544 A564 T567 L568 F571	Y510-M514 HydrophobicContact CD1-CG 4.34Å; Y510-M514 HydrophobicContact CD2-CE 4.04Å; Y510-M514 HydrophobicContact CE1-CE 4.23Å; Y510-M514 HydrophobicContact CE1-CG 4.25Å; Y510-M514 HydrophobicContact CE2-CE 3.44Å; Y510-M514 VanDerWaalsContact CE2-CE 3.44Å; Y510-M514 WeakPolarHBondContact O-CG 3.33Å; Y510-M514 PolarHBondContact O-N 3.47Å; M514-A518 WeakPolarHBondContact O-CB 3.15Å; M514-A518 PolarHBondContact O-N 3.4Å; M514-L540 HydrophobicContact CE-CD1 4.18Å; M514-L540 HydrophobicContact CE-CD2 3.98Å; M514-L540 HydrophobicContact CE-CG 4.42Å; M514-L540 HydrophobicContact SD-CD1 4.28Å; M514-L540 HydrophobicContact SD-CD2 3.8Å; M514-L544 HydrophobicContact CE-CD1 3.81Å; M514-A564 HydrophobicContact CE-CB 3.7Å; M514-T567 HydrophobicContact CB-CG2 3.93Å; M514-T567 HydrophobicContact CE-CG2 4.3Å; M514-T567 HydrophobicContact CG-CG2 3.45Å; M514-T567 VanDerWaalsContact CG-CG2 3.45Å; M514-T567 HydrophobicContact SD-CG2 3.7Å; M514-L568 WeakPolarHBondContact O-CD1 3.43Å; M514-L568 HydrophobicContact SD-CB 4.01Å; M514-L568 HydrophobicContact SD-CD1 4.44Å; M514-F571 HydrophobicContact CB-CD2 3.82Å; M514-F571 HydrophobicContact CB-CE2 4Å; M514-F571 HydrophobicContact CB-CG 4.15Å; M514-F571 HydrophobicContact CB-CZ 4.48Å
515	E	98.4	Very high	98	Very high	39 Å²	39	52.1 Å²	52.1	18%	0.182	27%	0.268	C	S	.	.	H	α-helix	trans	-67.3	-43.7	172.3	-174.4	171.7	177.2	0	0	112.6	Y511 Q513 F517 A518 R519 F571 I575 W585 K586	Y511-E515 WeakPolarHBondContact O-CB 3.2Å; Y511-E515 PolarHBondContact O-N 3.5Å; Q513-E515 VanDerWaalsContact C-N 3.33Å; Q513-E515 PolarHBondContact O-N 3.07Å; E515-F517 PolarHBondContact O-N 2.69Å; E515-A518 PolarHBondContact O-N 3.08Å; E515-R519 HydrophobicContact CG-CG 4.39Å; E515-R519 WeakPolarHBondContact O-CB 3.42Å; E515-R519 WeakPolarHBondContact O-CG 3.2Å; E515-R519 PolarHBondContact O-N 3.03Å; E515-R519 IonicContact OE1-CZ 3.22Å; E515-R519 VanDerWaalsContact OE1-CZ 3.25Å; E515-R519 IonicContact OE1-NE 2.71Å; E515-R519 PolarHBondContact OE1-NE 3.18Å; E515-R519 IonicContact OE1-NH2 2.8Å; E515-R519 PolarHBondContact OE1-NH2 3.43Å; E515-F571 HydrophobicContact CB-CD1 3.88Å; E515-F571 HydrophobicContact CB-CE1 3.91Å; E515-F571 HydrophobicContact CG-CD1 4.47Å; E515-I575 HydrophobicContact CG-CD1 4.27Å; E515-W585 HydrophobicContact CG-CH2 4.39Å; E515-K586 VanDerWaalsContact OE2-CE 3.31Å; E515-K586 WeakPolarHBondContact OE2-CE 3.38Å; E515-K586 IonicContact OE2-NZ 2.64Å; E515-K586 PolarHBondContact OE2-NZ 3.26Å
516	K	98.4	Very high	97.9	Very high	98 Å²	98	50.2 Å²	50.2	43%	0.426	26%	0.259	S	S	.	.	H	α-helix	trans	-55.7	-52.1	177.4	-177.5	-143	169.3	-153.4	0	110.8	I512 Q513 R519 Q520 E539	I512-K516 VanDerWaalsContact O-CB 3.3Å; I512-K516 WeakPolarHBondContact O-CB 3.37Å; I512-K516 PolarHBondContact O-N 2.87Å; Q513-K516 WeakPolarHBondContact O-CB 3.28Å; Q513-K516 PolarHBondContact O-N 3.1Å; Q513-K516 VanDerWaalsContact O-N 3.13Å; K516-R519 PolarHBondContact O-N 3.21Å; K516-Q520 WeakPolarHBondContact O-CB 3.49Å; K516-Q520 PolarHBondContact O-N 2.88Å; K516-E539 IonicContact NZ-OE2 3.19Å; K516-E539 PolarHBondContact NZ-OE2 2.87Å
517	F	98.4	Very high	97.5	Very high	27 Å²	27	60.3 Å²	60.3	12%	0.118	30%	0.297	C	S	.	.	H	α-helix	trans	-72.9	-32.8	-177.1	-76.5	-80.3	0	0	0	112.9	Q513 E515 Q520 A521 E539 L540 L568	Q513-F517 HydrophobicContact CB-CD2 4.48Å; Q513-F517 VanDerWaalsContact O-CD2 3.31Å; Q513-F517 WeakPolarHBondContact O-CD2 3.22Å; Q513-F517 PolarHBondContact O-N 2.82Å; E515-F517 PolarHBondContact O-N 2.69Å; F517-Q520 PolarHBondContact O-N 3.22Å; F517-A521 PolarHBondContact O-N 3.14Å; F517-E539 HydrophobicContact CE1-CB 3.95Å; F517-E539 HydrophobicContact CE1-CG 4.12Å; F517-E539 WeakPolarHBondContact CE1-OE2 3.48Å; F517-E539 HydrophobicContact CZ-CB 4.03Å; F517-E539 HydrophobicContact CZ-CG 3.77Å; F517-E539 VanDerWaalsContact CZ-OE2 3.27Å; F517-E539 WeakPolarHBondContact CZ-OE2 3.47Å; F517-L540 HydrophobicContact CD1-CB 4.41Å; F517-L540 HydrophobicContact CD2-CB 3.99Å; F517-L540 HydrophobicContact CD2-CD1 3.65Å; F517-L540 HydrophobicContact CD2-CG 4.34Å; F517-L540 HydrophobicContact CE2-CB 4.17Å; F517-L540 HydrophobicContact CE2-CD1 4.08Å; F517-L540 HydrophobicContact CG-CB 4.12Å; F517-L540 HydrophobicContact CG-CD1 4.35Å; F517-L540 HydrophobicContact CZ-CB 4.46Å; F517-L568 HydrophobicContact CB-CD1 3.82Å
518	A	98.3	Very high	97.2	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-43.2	171.3	0	0	0	0	0	112.1	M514 E515 I522 L568 F571 I575	M514-A518 WeakPolarHBondContact O-CB 3.15Å; M514-A518 PolarHBondContact O-N 3.4Å; E515-A518 PolarHBondContact O-N 3.08Å; A518-I522 WeakPolarHBondContact O-CG1 3.17Å; A518-I522 PolarHBondContact O-N 3.04Å; A518-L568 HydrophobicContact CB-CD1 4.08Å; A518-F571 HydrophobicContact CB-CB 3.79Å; A518-I575 HydrophobicContact CB-CD1 3.89Å
519	R	98.1	Very high	97	Very high	95 Å²	95	57.1 Å²	57.1	36%	0.358	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-36	174.7	-69.3	-175.5	-172.8	-70.5	-0.8	112.1	E515 K516 I522 A523 I575 D580	E515-R519 HydrophobicContact CG-CG 4.39Å; E515-R519 WeakPolarHBondContact O-CB 3.42Å; E515-R519 WeakPolarHBondContact O-CG 3.2Å; E515-R519 PolarHBondContact O-N 3.03Å; E515-R519 IonicContact OE1-CZ 3.22Å; E515-R519 VanDerWaalsContact OE1-CZ 3.25Å; E515-R519 IonicContact OE1-NE 2.71Å; E515-R519 PolarHBondContact OE1-NE 3.18Å; E515-R519 IonicContact OE1-NH2 2.8Å; E515-R519 PolarHBondContact OE1-NH2 3.43Å; K516-R519 PolarHBondContact O-N 3.21Å; R519-I522 PolarHBondContact O-N 2.92Å; R519-A523 WeakPolarHBondContact O-CB 3.42Å; R519-A523 PolarHBondContact O-N 2.86Å; R519-I575 HydrophobicContact CG-CD1 3.83Å; R519-I575 HydrophobicContact CG-CG2 4.35Å; R519-D580 IonicContact CZ-OD2 2.72Å; R519-D580 IonicContact NH1-OD2 2.61Å; R519-D580 PolarHBondContact NH1-OD2 3.07Å; R519-D580 IonicContact NH2-OD2 2.66Å; R519-D580 PolarHBondContact NH2-OD2 2.95Å
520	Q	98	Very high	96.8	Very high	84 Å²	84	61.9 Å²	61.9	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-61.9	-49.9	175.9	-172.7	64.3	28	0	0	111.6	K516 F517 I522 A523 E524	K516-Q520 WeakPolarHBondContact O-CB 3.49Å; K516-Q520 PolarHBondContact O-N 2.88Å; F517-Q520 PolarHBondContact O-N 3.22Å; Q520-I522 VanDerWaalsContact C-N 3.27Å; Q520-I522 PolarHBondContact O-N 3.33Å; Q520-A523 CarbonylContact O-C 3.58Å; Q520-A523 WeakPolarHBondContact O-CB 3.29Å; Q520-A523 PolarHBondContact O-N 2.96Å; Q520-E524 WeakPolarHBondContact CG-OE1 3.46Å; Q520-E524 PolarHBondContact NE2-OE1 3.04Å; Q520-E524 WeakPolarHBondContact O-CG 3.47Å; Q520-E524 PolarHBondContact O-N 3.11Å
521	A	97.6	Very high	96.5	Very high	9 Å²	9	67.1 Å²	67.1	7%	0.074	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-36.3	178.3	0	0	0	0	0	112.9	F517 E524 G525 V526 I532 Y572	F517-A521 PolarHBondContact O-N 3.14Å; A521-E524 PolarHBondContact O-N 3.11Å; A521-G525 PolarHBondContact O-N 3.47Å; A521-V526 HydrophobicContact CB-CB 4.29Å; A521-V526 HydrophobicContact CB-CG2 4.12Å; A521-V526 WeakPolarHBondContact O-CB 3.5Å; A521-V526 WeakPolarHBondContact O-CG2 3.26Å; A521-V526 PolarHBondContact O-N 3.2Å; A521-I532 HydrophobicContact CB-CD1 3.78Å; A521-I532 HydrophobicContact CB-CG1 4.31Å; A521-Y572 HydrophobicContact CB-CD2 4.4Å
522	I	96.9	Very high	96.4	Very high	59 Å²	59	67.2 Å²	67.2	30%	0.303	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-41.6	173.9	-66.2	168.6	0	0	0	111.1	A518 R519 Q520 E524 G525 Y572 I575	A518-I522 WeakPolarHBondContact O-CG1 3.17Å; A518-I522 PolarHBondContact O-N 3.04Å; R519-I522 PolarHBondContact O-N 2.92Å; Q520-I522 VanDerWaalsContact C-N 3.27Å; Q520-I522 PolarHBondContact O-N 3.33Å; I522-E524 VanDerWaalsContact C-N 3.32Å; I522-E524 PolarHBondContact O-N 3.45Å; I522-G525 PolarHBondContact O-N 3.39Å; I522-G525 VanDerWaalsContact O-N 3.17Å; I522-Y572 HydrophobicContact CD1-CD2 3.97Å; I522-Y572 HydrophobicContact CD1-CE2 4.21Å; I522-Y572 HydrophobicContact CG1-CD2 3.55Å; I522-Y572 HydrophobicContact CG1-CE2 3.4Å; I522-Y572 VanDerWaalsContact CG1-CE2 3.4Å; I522-I575 HydrophobicContact CD1-CB 3.75Å; I522-I575 HydrophobicContact CD1-CG2 3.53Å
523	A	97.4	Very high	96.3	Very high	85 Å²	85	66.7 Å²	66.7	70%	0.702	34%	0.339	S	S	*	.	H	α-helix	trans	-68.2	-29.7	177	0	0	0	0	0	113.1	R519 Q520 G525	R519-A523 WeakPolarHBondContact O-CB 3.42Å; R519-A523 PolarHBondContact O-N 2.86Å; Q520-A523 CarbonylContact O-C 3.58Å; Q520-A523 WeakPolarHBondContact O-CB 3.29Å; Q520-A523 PolarHBondContact O-N 2.96Å; A523-G525 VanDerWaalsContact C-N 3.25Å; A523-G525 PolarHBondContact O-N 3.1Å
524	E	96.3	Very high	96.2	Very high	129 Å²	129	65.7 Å²	65.7	60%	0.603	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.1	173.3	-71.8	167.6	175.3	0	0	113.1	Q520 A521 I522	Q520-E524 WeakPolarHBondContact CG-OE1 3.46Å; Q520-E524 PolarHBondContact NE2-OE1 3.04Å; Q520-E524 WeakPolarHBondContact O-CG 3.47Å; Q520-E524 PolarHBondContact O-N 3.11Å; A521-E524 PolarHBondContact O-N 3.11Å; I522-E524 VanDerWaalsContact C-N 3.32Å; I522-E524 PolarHBondContact O-N 3.45Å
525	G	94.8	Very high	96.1	Very high	42 Å²	42	67.8 Å²	67.8	43%	0.433	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	21.4	175.4	0	0	0	0	0	114.9	A521 I522 A523 R527	A521-G525 PolarHBondContact O-N 3.47Å; I522-G525 PolarHBondContact O-N 3.39Å; I522-G525 VanDerWaalsContact O-N 3.17Å; A523-G525 VanDerWaalsContact C-N 3.25Å; A523-G525 PolarHBondContact O-N 3.1Å; G525-R527 WeakPolarHBondContact O-CG 3.29Å
526	V	96.1	Very high	96	Very high	42 Å²	42	70.6 Å²	70.6	26%	0.255	36%	0.359	S	S	.	.			trans	-59.7	140	169.3	-177.1	0	0	0	0	109.3	A521 D528 D531 I532 Y572	A521-V526 HydrophobicContact CB-CB 4.29Å; A521-V526 HydrophobicContact CB-CG2 4.12Å; A521-V526 WeakPolarHBondContact O-CB 3.5Å; A521-V526 WeakPolarHBondContact O-CG2 3.26Å; A521-V526 PolarHBondContact O-N 3.2Å; V526-D528 WeakPolarHBondContact CG1-O 3.4Å; V526-D531 HydrophobicContact CG1-CB 3.78Å; V526-I532 HydrophobicContact CG1-CD1 4.18Å; V526-I532 HydrophobicContact CG1-CG1 3.75Å; V526-Y572 PolarHBondContact O-OH 3.36Å
527	R	90.9	Very high	95.9	Very high	216 Å²	216	72.8 Å²	72.8	82%	0.815	38%	0.375	S	S	*	.			trans	-119.6	-43	-171.2	-63.4	-171.2	-57.9	-74.2	-1.6	114.4	G525 Y572	G525-R527 WeakPolarHBondContact O-CG 3.29Å; R527-Y572 PolarHBondContact O-OH 3.37Å
528	D	92.3	Very high	95.8	Very high	60 Å²	60	72.4 Å²	72.4	32%	0.321	38%	0.375	S	S	.	.	S	Bend	trans	-91.1	139.3	169.3	-162.2	-23.9	0	0	0	108.9	V526 K530 D531	V526-D528 WeakPolarHBondContact CG1-O 3.4Å; D528-K530 PolarHBondContact O-N 3.32Å; D528-K530 WeakPolarHBondContact OD1-CG 3.31Å; D528-K530 PolarHBondContact OD1-N 3.14Å; D528-K530 IonicContact OD1-NZ 3.66Å; D528-K530 IonicContact OD2-NZ 2.71Å; D528-K530 PolarHBondContact OD2-NZ 3.21Å; D528-D531 PolarHBondContact N-OD2 3.12Å; D528-D531 WeakPolarHBondContact O-CB 3.48Å; D528-D531 PolarHBondContact O-N 3Å
529	V	94.3	Very high	95.8	Very high	28 Å²	28	76.7 Å²	76.7	17%	0.17	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-65.1	-24.2	172.9	67.8	0	0	0	0	111.4	D531 I532 H569 Y572	V529-D531 VanDerWaalsContact C-N 3.28Å; V529-D531 PolarHBondContact O-N 3.37Å; V529-I532 WeakPolarHBondContact O-CB 3.31Å; V529-I532 PolarHBondContact O-N 3.42Å; V529-H569 HydrophobicContact CG2-CB 3.61Å; V529-H569 VanDerWaalsContact CG2-CG 3.49Å; V529-H569 PolarHBondContact O-NE2 3.32Å; V529-Y572 HydrophobicContact CB-CD1 3.83Å; V529-Y572 HydrophobicContact CB-CE1 3.9Å; V529-Y572 HydrophobicContact CG2-CD1 3.69Å; V529-Y572 HydrophobicContact CG2-CE1 4.28Å; V529-Y572 HydrophobicContact CG2-CG 4.44Å
530	K	93.8	Very high	95.8	Very high	149 Å²	149	72.4 Å²	72.4	65%	0.648	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-67.4	-22.9	175.5	-60.7	-175.1	-149	99.6	0	114.3	D528 I532	D528-K530 PolarHBondContact O-N 3.32Å; D528-K530 WeakPolarHBondContact OD1-CG 3.31Å; D528-K530 PolarHBondContact OD1-N 3.14Å; D528-K530 IonicContact OD1-NZ 3.66Å; D528-K530 IonicContact OD2-NZ 2.71Å; D528-K530 PolarHBondContact OD2-NZ 3.21Å; K530-I532 PolarHBondContact O-N 3.43Å
531	D	92.9	Very high	95.8	Very high	109 Å²	109	69.2 Å²	69.2	58%	0.583	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-71	-15.2	175.7	-57.4	-31.3	0	0	0	111.2	V526 D528 V529	V526-D531 HydrophobicContact CG1-CB 3.78Å; D528-D531 PolarHBondContact N-OD2 3.12Å; D528-D531 WeakPolarHBondContact O-CB 3.48Å; D528-D531 PolarHBondContact O-N 3Å; V529-D531 VanDerWaalsContact C-N 3.28Å; V529-D531 PolarHBondContact O-N 3.37Å
532	I	95.7	Very high	95.8	Very high	16 Å²	16	75.9 Å²	75.9	8%	0.082	39%	0.388	C	S	.	.			trans	-96.2	101	-177.5	-50.3	177.5	0	0	0	109.4	A521 V526 V529 K530 L568 H569 Y572	A521-I532 HydrophobicContact CB-CD1 3.78Å; A521-I532 HydrophobicContact CB-CG1 4.31Å; V526-I532 HydrophobicContact CG1-CD1 4.18Å; V526-I532 HydrophobicContact CG1-CG1 3.75Å; V529-I532 WeakPolarHBondContact O-CB 3.31Å; V529-I532 PolarHBondContact O-N 3.42Å; K530-I532 PolarHBondContact O-N 3.43Å; I532-L568 HydrophobicContact CG2-CD2 3.32Å; I532-L568 HydrophobicContact CG2-CG 3.88Å; I532-H569 PolarHBondContact O-NE2 3.04Å; I532-Y572 HydrophobicContact CD1-CD1 4.07Å; I532-Y572 HydrophobicContact CD1-CD2 3.35Å; I532-Y572 HydrophobicContact CD1-CE1 4.31Å; I532-Y572 HydrophobicContact CD1-CE2 3.63Å; I532-Y572 HydrophobicContact CD1-CG 3.6Å
533	T	96.1	Very high	95.9	Very high	86 Å²	86	74.4 Å²	74.4	53%	0.528	38%	0.384	S	S	.	.			trans	-115.6	150.9	178.8	56.5	0	0	0	0	113.1	E565	T533-E565 WeakPolarHBondContact CA-OE2 3.48Å; T533-E565 WeakPolarHBondContact CB-OE2 3.2Å
534	V	97.6	Very high	95.9	Very high	6 Å²	6	70.3 Å²	70.3	4%	0.036	35%	0.351	C	S	.	.			trans	-115.7	77	-178.2	-171.4	0	0	0	0	111.5	L540 A564 E565 L568	V534-L540 HydrophobicContact CG1-CD2 4.09Å; V534-L540 HydrophobicContact CG1-CG 4.39Å; V534-L540 HydrophobicContact CG2-CD2 3.88Å; V534-A564 HydrophobicContact CG1-CB 3.98Å; V534-E565 HydrophobicContact CB-CB 3.99Å; V534-E565 HydrophobicContact CG2-CB 3.85Å; V534-E565 HydrophobicContact CG2-CG 4.24Å; V534-E565 PolarHBondContact N-OE2 3.28Å; V534-L568 HydrophobicContact CG2-CB 4.46Å; V534-L568 HydrophobicContact CG2-CD2 3.74Å
535	S	96.6	Very high	96	Very high	44 Å²	44	65 Å²	65	31%	0.308	33%	0.327	S	S	.	.			trans	-80.4	171.9	175.4	64.3	0	0	0	0	113.3	D537 S538 F541	S535-D537 WeakPolarHBondContact CB-OD1 3.49Å; S535-D537 PolarHBondContact O-N 3.5Å; S535-D537 PolarHBondContact OG-OD1 3.36Å; S535-S538 WeakPolarHBondContact O-CB 3.38Å; S535-S538 PolarHBondContact O-N 2.85Å; S535-S538 PolarHBondContact O-OG 2.91Å; S535-S538 PolarHBondContact OG-N 3.44Å; S535-F541 WeakPolarHBondContact O-CB 3.36Å
536	R	95.7	Very high	96.1	Very high	99 Å²	99	69.2 Å²	69.2	37%	0.374	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.6	176.8	-73.1	-169.4	175.5	78.6	-1.8	114.3	F541 H555 V556 D558 L561	R536-F541 HydrophobicContact CB-CD1 4.37Å; R536-F541 HydrophobicContact CB-CE1 4.35Å; R536-F541 HydrophobicContact CG-CE1 4.38Å; R536-F541 WeakPolarHBondContact O-CD1 3.47Å; R536-H555 PolarHBondContact NH2-NE2 2.88Å; R536-V556 PolarHBondContact NH2-O 2.91Å; R536-V556 VanDerWaalsContact NH2-O 3.08Å; R536-D558 IonicContact CZ-OD1 2.67Å; R536-D558 IonicContact NH1-OD1 3.84Å; R536-D558 PolarHBondContact NH1-OD1 3.44Å; R536-D558 VanDerWaalsContact NH2-CG 3.29Å; R536-D558 IonicContact NH2-OD1 3.64Å; R536-D558 PolarHBondContact NH2-OD1 3.29Å; R536-D558 IonicContact NH2-OD2 2.77Å; R536-D558 PolarHBondContact NH2-OD2 2.87Å; R536-L561 HydrophobicContact CG-CD1 3.64Å
537	D	96.1	Very high	96.2	Very high	143 Å²	143	69.4 Å²	69.4	77%	0.765	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-10.8	174	58.2	-51.2	0	0	0	113.2	S535	S535-D537 WeakPolarHBondContact CB-OD1 3.49Å; S535-D537 PolarHBondContact O-N 3.5Å; S535-D537 PolarHBondContact OG-OD1 3.36Å
538	S	97.1	Very high	96.5	Very high	19 Å²	19	59.4 Å²	59.4	13%	0.133	30%	0.297	C	S	.	.	S	Bend	trans	-60.1	143.2	177.1	72.8	0	0	0	0	112.8	S535 L540 F541 R542	S535-S538 WeakPolarHBondContact O-CB 3.38Å; S535-S538 PolarHBondContact O-N 2.85Å; S535-S538 PolarHBondContact O-OG 2.91Å; S535-S538 PolarHBondContact OG-N 3.44Å; S538-L540 VanDerWaalsContact C-N 3.25Å; S538-L540 PolarHBondContact O-N 2.88Å; S538-F541 PolarHBondContact O-N 3.5Å; S538-F541 WeakPolarHBondContact OG-CB 3.49Å; S538-F541 PolarHBondContact OG-N 3.31Å; S538-R542 PolarHBondContact O-N 2.93Å
539	E	97.8	Very high	96.7	Very high	90 Å²	90	56.7 Å²	56.7	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-34.9	178.1	-173.7	178.3	-119.4	0	0	111.8	K516 F517 R542 A543	K516-E539 IonicContact NZ-OE2 3.19Å; K516-E539 PolarHBondContact NZ-OE2 2.87Å; F517-E539 HydrophobicContact CE1-CB 3.95Å; F517-E539 HydrophobicContact CE1-CG 4.12Å; F517-E539 WeakPolarHBondContact CE1-OE2 3.48Å; F517-E539 HydrophobicContact CZ-CB 4.03Å; F517-E539 HydrophobicContact CZ-CG 3.77Å; F517-E539 VanDerWaalsContact CZ-OE2 3.27Å; F517-E539 WeakPolarHBondContact CZ-OE2 3.47Å; E539-R542 WeakPolarHBondContact O-CB 3.43Å; E539-R542 PolarHBondContact O-N 3.24Å; E539-R542 IonicContact OE1-CZ 3.88Å; E539-R542 IonicContact OE1-NH2 3.37Å; E539-R542 PolarHBondContact OE1-NH2 3.15Å; E539-A543 WeakPolarHBondContact O-CB 3.42Å; E539-A543 PolarHBondContact O-N 3.23Å
540	L	98.3	Very high	96.6	Very high	6 Å²	6	64 Å²	64	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-57.9	-50.4	174.6	173.2	60.1	0	0	0	111.1	Q513 M514 F517 V534 S538 R542 A543 L544 L568	Q513-L540 HydrophobicContact CB-CD1 3.79Å; M514-L540 HydrophobicContact CE-CD1 4.18Å; M514-L540 HydrophobicContact CE-CD2 3.98Å; M514-L540 HydrophobicContact CE-CG 4.42Å; M514-L540 HydrophobicContact SD-CD1 4.28Å; M514-L540 HydrophobicContact SD-CD2 3.8Å; F517-L540 HydrophobicContact CD1-CB 4.41Å; F517-L540 HydrophobicContact CD2-CB 3.99Å; F517-L540 HydrophobicContact CD2-CD1 3.65Å; F517-L540 HydrophobicContact CD2-CG 4.34Å; F517-L540 HydrophobicContact CE2-CB 4.17Å; F517-L540 HydrophobicContact CE2-CD1 4.08Å; F517-L540 HydrophobicContact CG-CB 4.12Å; F517-L540 HydrophobicContact CG-CD1 4.35Å; F517-L540 HydrophobicContact CZ-CB 4.46Å; V534-L540 HydrophobicContact CG1-CD2 4.09Å; V534-L540 HydrophobicContact CG1-CG 4.39Å; V534-L540 HydrophobicContact CG2-CD2 3.88Å; S538-L540 VanDerWaalsContact C-N 3.25Å; S538-L540 PolarHBondContact O-N 2.88Å; L540-R542 VanDerWaalsContact C-N 3.34Å; L540-R542 PolarHBondContact O-N 2.91Å; L540-A543 PolarHBondContact O-N 3.36Å; L540-L544 HydrophobicContact CD1-CD1 3.76Å; L540-L544 HydrophobicContact CD1-CD2 4.48Å; L540-L544 HydrophobicContact CD1-CG 3.98Å; L540-L544 HydrophobicContact CG-CD1 3.98Å; L540-L544 VanDerWaalsContact O-CG 3.27Å; L540-L544 WeakPolarHBondContact O-CG 3.35Å; L540-L544 PolarHBondContact O-N 2.66Å; L540-L568 HydrophobicContact CD2-CB 4.46Å; L540-L568 HydrophobicContact CD2-CD1 4.33Å; L540-L568 HydrophobicContact CD2-CD2 3.75Å; L540-L568 HydrophobicContact CD2-CG 4.42Å
541	F	98.3	Very high	96.5	Very high	17 Å²	17	60.2 Å²	60.2	8%	0.075	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-44.8	175.7	176.6	-101.2	0	0	0	111.4	S535 R536 S538 A543 L544 N545 V556 L561	S535-F541 WeakPolarHBondContact O-CB 3.36Å; R536-F541 HydrophobicContact CB-CD1 4.37Å; R536-F541 HydrophobicContact CB-CE1 4.35Å; R536-F541 HydrophobicContact CG-CE1 4.38Å; R536-F541 WeakPolarHBondContact O-CD1 3.47Å; S538-F541 PolarHBondContact O-N 3.5Å; S538-F541 WeakPolarHBondContact OG-CB 3.49Å; S538-F541 PolarHBondContact OG-N 3.31Å; F541-A543 VanDerWaalsContact C-N 3.31Å; F541-A543 PolarHBondContact O-N 2.91Å; F541-L544 PolarHBondContact O-N 3.31Å; F541-N545 HydrophobicContact CD1-CB 4.37Å; F541-N545 HydrophobicContact CE1-CB 3.96Å; F541-N545 HydrophobicContact CE2-CB 4.18Å; F541-N545 HydrophobicContact CZ-CB 3.86Å; F541-N545 WeakPolarHBondContact O-CB 3.42Å; F541-N545 PolarHBondContact O-N 3.4Å; F541-V556 HydrophobicContact CE2-CB 3.88Å; F541-V556 HydrophobicContact CE2-CG1 3.94Å; F541-V556 HydrophobicContact CE2-CG2 4.02Å; F541-V556 HydrophobicContact CZ-CB 4Å; F541-V556 HydrophobicContact CZ-CG2 3.94Å; F541-L561 HydrophobicContact CB-CD2 4.37Å; F541-L561 HydrophobicContact CD2-CD2 3.3Å; F541-L561 HydrophobicContact CE2-CD2 3.74Å; F541-L561 HydrophobicContact CG-CD2 3.94Å
542	R	97.6	Very high	96.4	Very high	149 Å²	149	60.4 Å²	60.4	56%	0.562	31%	0.309	S	S	*	.	H	α-helix	trans	-53.8	-45.4	176.2	-177.1	175.1	71.9	172.4	2	112.2	S538 E539 L540 M546	S538-R542 PolarHBondContact O-N 2.93Å; E539-R542 WeakPolarHBondContact O-CB 3.43Å; E539-R542 PolarHBondContact O-N 3.24Å; E539-R542 IonicContact OE1-CZ 3.88Å; E539-R542 IonicContact OE1-NH2 3.37Å; E539-R542 PolarHBondContact OE1-NH2 3.15Å; L540-R542 VanDerWaalsContact C-N 3.34Å; L540-R542 PolarHBondContact O-N 2.91Å; R542-M546 VanDerWaalsContact O-CB 3.25Å; R542-M546 WeakPolarHBondContact O-CB 3.35Å; R542-M546 PolarHBondContact O-N 3.43Å
543	A	98	Very high	96.2	Very high	27 Å²	27	63.5 Å²	63.5	22%	0.223	33%	0.326	C	S	.	.	H	α-helix	trans	-68.6	-40.9	179.5	0	0	0	0	0	113	E539 L540 F541 H547	E539-A543 WeakPolarHBondContact O-CB 3.42Å; E539-A543 PolarHBondContact O-N 3.23Å; L540-A543 PolarHBondContact O-N 3.36Å; F541-A543 VanDerWaalsContact C-N 3.31Å; F541-A543 PolarHBondContact O-N 2.91Å; A543-H547 PolarHBondContact O-N 2.8Å
544	L	98.3	Very high	96.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.6	-48	176.9	-64.3	172.3	0	0	0	111.3	F509 Y510 Q513 M514 L540 F541 M546 H547 Y548 F560	F509-L544 HydrophobicContact CD1-CD2 4.5Å; F509-L544 HydrophobicContact CE1-CD2 4.18Å; Y510-L544 HydrophobicContact CD2-CD1 4.35Å; Y510-L544 HydrophobicContact CD2-CD2 3.93Å; Y510-L544 HydrophobicContact CE2-CD1 4.36Å; Q513-L544 HydrophobicContact CB-CD2 4.09Å; Q513-L544 HydrophobicContact CG-CD2 4Å; M514-L544 HydrophobicContact CE-CD1 3.81Å; L540-L544 HydrophobicContact CD1-CD1 3.76Å; L540-L544 HydrophobicContact CD1-CD2 4.48Å; L540-L544 HydrophobicContact CD1-CG 3.98Å; L540-L544 HydrophobicContact CG-CD1 3.98Å; L540-L544 VanDerWaalsContact O-CG 3.27Å; L540-L544 WeakPolarHBondContact O-CG 3.35Å; L540-L544 PolarHBondContact O-N 2.66Å; F541-L544 PolarHBondContact O-N 3.31Å; L544-M546 PolarHBondContact O-N 3.36Å; L544-H547 WeakPolarHBondContact O-CB 3.41Å; L544-H547 PolarHBondContact O-N 3.09Å; L544-H547 VanDerWaalsContact O-N 3.07Å; L544-Y548 HydrophobicContact CB-CD2 4.4Å; L544-Y548 HydrophobicContact CB-CE2 4.32Å; L544-Y548 HydrophobicContact CD2-CE2 4.07Å; L544-Y548 WeakPolarHBondContact O-CD2 3.35Å; L544-Y548 PolarHBondContact O-N 3.19Å; L544-F560 HydrophobicContact CD1-CE1 4.16Å; L544-F560 HydrophobicContact CD1-CZ 4.12Å
545	N	97.6	Very high	95.9	Very high	18 Å²	18	66.2 Å²	66.2	10%	0.096	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-46.2	-179.8	-170.5	51	0	0	0	111	F541 H547 Y548 N549 N552 V556	F541-N545 HydrophobicContact CD1-CB 4.37Å; F541-N545 HydrophobicContact CE1-CB 3.96Å; F541-N545 HydrophobicContact CE2-CB 4.18Å; F541-N545 HydrophobicContact CZ-CB 3.86Å; F541-N545 WeakPolarHBondContact O-CB 3.42Å; F541-N545 PolarHBondContact O-N 3.4Å; N545-H547 PolarHBondContact O-N 3.23Å; N545-Y548 PolarHBondContact O-N 3Å; N545-N549 CarbonylContact O-C 3.4Å; N545-N549 VanDerWaalsContact O-CA 3.31Å; N545-N549 WeakPolarHBondContact O-CA 3.4Å; N545-N549 VanDerWaalsContact O-CB 3.3Å; N545-N549 WeakPolarHBondContact O-CB 3.32Å; N545-N549 PolarHBondContact O-N 3.38Å; N545-N549 VanDerWaalsContact OD1-CB 3.27Å; N545-N549 WeakPolarHBondContact OD1-CB 3.42Å; N545-N549 PolarHBondContact OD1-ND2 3.32Å; N545-N552 PolarHBondContact ND2-OD1 3.37Å; N545-V556 WeakPolarHBondContact OD1-CG2 3.26Å
546	M	97.1	Very high	95.9	Very high	130 Å²	130	64.4 Å²	64.4	64%	0.64	32%	0.318	S	S	*	.	H	α-helix	trans	-56.6	-32.9	173.7	-172.5	65	68	0	0	113.1	R542 L544	R542-M546 VanDerWaalsContact O-CB 3.25Å; R542-M546 WeakPolarHBondContact O-CB 3.35Å; R542-M546 PolarHBondContact O-N 3.43Å; L544-M546 PolarHBondContact O-N 3.36Å
547	H	97.5	Very high	95.9	Very high	46 Å²	46	60.9 Å²	60.9	21%	0.213	31%	0.308	C	S	.	.	H	α-helix	trans	-77.9	-47.7	179	-172.8	103	0	0	0	113.2	K468 F509 A543 L544 N545	K468-H547 PolarHBondContact NZ-CD2 2.77Å; K468-H547 PolarHBondContact NZ-NE2 3.32Å; K468-H547 PolarHBondContact NZ-O 3.17Å; F509-H547 HydrophobicContact CD1-CB 3.93Å; F509-H547 AromaticContact CD1-CD2 3.95Å; F509-H547 AromaticContact CD1-CG 3.53Å; F509-H547 AromaticContact CD1-ND1 3.57Å; F509-H547 AromaticContact CD2-CE1 3.89Å; F509-H547 AromaticContact CD2-ND1 3.57Å; F509-H547 HydrophobicContact CE1-CB 3.33Å; F509-H547 AromaticContact CE1-CG 3.43Å; F509-H547 VanDerWaalsContact CE1-CG 3.43Å; F509-H547 AromaticContact CE1-ND1 3.57Å; F509-H547 AromaticContact CE2-ND1 3.57Å; F509-H547 AromaticContact CG-CE1 3.73Å; F509-H547 AromaticContact CG-ND1 3.58Å; F509-H547 HydrophobicContact CZ-CB 3.72Å; F509-H547 AromaticContact CZ-CG 3.83Å; F509-H547 AromaticContact CZ-ND1 3.57Å; A543-H547 PolarHBondContact O-N 2.8Å; L544-H547 WeakPolarHBondContact O-CB 3.41Å; L544-H547 PolarHBondContact O-N 3.09Å; L544-H547 VanDerWaalsContact O-N 3.07Å; N545-H547 PolarHBondContact O-N 3.23Å
548	Y	97.9	Very high	95.9	Very high	5 Å²	5	58 Å²	58	2%	0.02	29%	0.293	C	S	.	.	H	α-helix	trans	-87.1	-36.1	-174.1	-61.1	-63.5	0	0	0	113	K468 F471 F472 F506 F509 L544 N545	K468-Y548 HydrophobicContact CB-CD1 4.25Å; K468-Y548 WeakPolarHBondContact CB-O 3.48Å; K468-Y548 HydrophobicContact CG-CD1 4.24Å; F471-Y548 HydrophobicContact CB-CD1 4.27Å; F471-Y548 HydrophobicContact CB-CE1 4.47Å; F471-Y548 AromaticContact CD1-CD1 3.96Å; F471-Y548 HydrophobicContact CD1-CD1 3.96Å; F471-Y548 HydrophobicContact CD1-CD2 4.14Å; F471-Y548 AromaticContact CD1-CE1 3.56Å; F471-Y548 HydrophobicContact CD1-CE1 3.56Å; F471-Y548 AromaticContact CD1-CE2 3.75Å; F471-Y548 HydrophobicContact CD1-CE2 3.75Å; F471-Y548 HydrophobicContact CD1-CG 4.26Å; F471-Y548 AromaticContact CD1-CZ 3.46Å; F471-Y548 VanDerWaalsContact CD1-CZ 3.46Å; F471-Y548 AromaticContact CE1-CE1 3.88Å; F471-Y548 HydrophobicContact CE1-CE1 3.88Å; F471-Y548 AromaticContact CE1-CE2 3.79Å; F471-Y548 HydrophobicContact CE1-CE2 3.79Å; F471-Y548 AromaticContact CE1-CZ 3.38Å; F471-Y548 VanDerWaalsContact CE1-OH 3.29Å; F471-Y548 WeakPolarHBondContact CE1-OH 3.48Å; F471-Y548 HydrophobicContact CG-CD1 4.28Å; F471-Y548 HydrophobicContact CG-CE1 4.01Å; F472-Y548 HydrophobicContact CE1-CD2 4.21Å; F472-Y548 HydrophobicContact CZ-CD2 4.48Å; F472-Y548 HydrophobicContact CZ-CG 4.48Å; F506-Y548 HydrophobicContact CB-CE1 3.88Å; F506-Y548 HydrophobicContact CD1-CE1 4.39Å; F506-Y548 HydrophobicContact CG-CE1 4.11Å; F506-Y548 PolarHBondContact O-OH 3.5Å; F509-Y548 HydrophobicContact CD1-CE2 4.39Å; L544-Y548 HydrophobicContact CB-CD2 4.4Å; L544-Y548 HydrophobicContact CB-CE2 4.32Å; L544-Y548 HydrophobicContact CD2-CE2 4.07Å; L544-Y548 WeakPolarHBondContact O-CD2 3.35Å; L544-Y548 PolarHBondContact O-N 3.19Å; N545-Y548 PolarHBondContact O-N 3Å
549	N	96.3	Very high	95.9	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.016	31%	0.307	C	S	.	.			trans	-117.3	58.3	-170.6	-174.2	15.3	0	0	0	110.1	L469 F472 N545 A551 N552 D553 F554	L469-N549 HydrophobicContact CD2-CB 3.9Å; F472-N549 HydrophobicContact CE2-CB 4.05Å; F472-N549 HydrophobicContact CZ-CB 4.04Å; N545-N549 CarbonylContact O-C 3.4Å; N545-N549 VanDerWaalsContact O-CA 3.31Å; N545-N549 WeakPolarHBondContact O-CA 3.4Å; N545-N549 VanDerWaalsContact O-CB 3.3Å; N545-N549 WeakPolarHBondContact O-CB 3.32Å; N545-N549 PolarHBondContact O-N 3.38Å; N545-N549 VanDerWaalsContact OD1-CB 3.27Å; N545-N549 WeakPolarHBondContact OD1-CB 3.42Å; N545-N549 PolarHBondContact OD1-ND2 3.32Å; N549-A551 PolarHBondContact O-N 3.4Å; N549-A551 VanDerWaalsContact O-N 3.08Å; N549-N552 PolarHBondContact O-N 3.44Å; N549-N552 WeakPolarHBondContact OD1-CA 3.36Å; N549-N552 PolarHBondContact OD1-N 3.47Å; N549-D553 PolarHBondContact OD1-N 3.35Å; N549-D553 PolarHBondContact OD1-OD1 3.36Å; N549-F554 PolarHBondContact ND2-O 3.38Å; N549-F554 PolarHBondContact OD1-N 3.15Å
550	K	92.4	Very high	95.8	Very high	183 Å²	183	58.5 Å²	58.5	80%	0.796	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.9	-170.8	-175.2	-177.8	175.6	-170.4	0	114
551	A	91.3	Very high	95.8	Very high	69 Å²	69	58.9 Å²	58.9	57%	0.57	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.3	178.3	0	0	0	0	0	113.4	N549 D553	N549-A551 PolarHBondContact O-N 3.4Å; N549-A551 VanDerWaalsContact O-N 3.08Å; A551-D553 HydrophobicContact CB-CB 4.26Å; A551-D553 PolarHBondContact O-N 2.85Å
552	N	92.2	Very high	95.8	Very high	112 Å²	112	63 Å²	63	60%	0.599	31%	0.31	S	S	*	.			trans	51.7	29.9	-173.1	-161	60.6	0	0	0	113.5	N545 N549	N545-N552 PolarHBondContact ND2-OD1 3.37Å; N549-N552 PolarHBondContact O-N 3.44Å; N549-N552 WeakPolarHBondContact OD1-CA 3.36Å; N549-N552 PolarHBondContact OD1-N 3.47Å
553	D	91	Very high	95.8	Very high	81 Å²	81	56.1 Å²	56.1	43%	0.433	29%	0.285	S	S	.	.			trans	-91.2	-19.8	-179.2	56.5	-10.5	0	0	0	112.5	K465 N549 A551	K465-D553 WeakPolarHBondContact CE-OD2 3.43Å; K465-D553 IonicContact NZ-OD1 2.74Å; K465-D553 IonicContact NZ-OD2 2.73Å; K465-D553 PolarHBondContact NZ-OD2 3.44Å; N549-D553 PolarHBondContact OD1-N 3.35Å; N549-D553 PolarHBondContact OD1-OD1 3.36Å; A551-D553 HydrophobicContact CB-CB 4.26Å; A551-D553 PolarHBondContact O-N 2.85Å
554	F	93.3	Very high	95.8	Very high	15 Å²	15	54.9 Å²	54.9	7%	0.066	27%	0.274	C	S	.	.	S	Bend	trans	-92.8	133.7	175	-179.7	-98.7	0	0	0	111.8	L469 F472 Y473 N549 V556 F604 Y609	L469-F554 HydrophobicContact CD1-CB 4.02Å; L469-F554 HydrophobicContact CD1-CD2 4.41Å; L469-F554 HydrophobicContact CD1-CG 4.2Å; L469-F554 HydrophobicContact CD2-CB 3.86Å; L469-F554 HydrophobicContact CD2-CD1 3.88Å; L469-F554 HydrophobicContact CD2-CG 3.93Å; L469-F554 HydrophobicContact CG-CG 4.49Å; F472-F554 AromaticContact CD2-CD1 3.82Å; F472-F554 HydrophobicContact CD2-CD1 3.82Å; F472-F554 AromaticContact CD2-CE1 3.55Å; F472-F554 HydrophobicContact CD2-CE1 3.55Å; F472-F554 AromaticContact CE2-CD1 3.86Å; F472-F554 HydrophobicContact CE2-CD1 3.86Å; F472-F554 HydrophobicContact CE2-CE1 4.08Å; F472-F554 HydrophobicContact CG-CE1 4.39Å; Y473-F554 AromaticContact CE2-CZ 3.8Å; Y473-F554 HydrophobicContact CE2-CZ 3.8Å; Y473-F554 WeakPolarHBondContact OH-CZ 3.45Å; N549-F554 PolarHBondContact ND2-O 3.38Å; N549-F554 PolarHBondContact OD1-N 3.15Å; F554-V556 HydrophobicContact CD1-CG2 4.32Å; F554-F604 HydrophobicContact CD2-CZ 4.49Å; F554-F604 HydrophobicContact CE2-CE2 4.03Å; F554-F604 AromaticContact CE2-CZ 3.69Å; F554-F604 HydrophobicContact CE2-CZ 3.69Å; F554-F604 HydrophobicContact CZ-CE2 4.36Å; F554-F604 HydrophobicContact CZ-CZ 4.01Å; F554-Y609 HydrophobicContact CD2-CE1 4.38Å; F554-Y609 HydrophobicContact CE2-CE1 4.28Å
555	H	94.3	Very high	95.8	Very high	135 Å²	135	57.4 Å²	57.4	63%	0.625	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-84.6	116.4	172.9	-175.7	90.9	0	0	0	110.8	R536	R536-H555 PolarHBondContact NH2-NE2 2.88Å
556	V	95.8	Very high	95.8	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.03	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-75	127.4	-178.9	-171.8	0	0	0	0	111.1	F472 R536 F541 N545 F554 F560	F472-V556 HydrophobicContact CB-CG1 4.41Å; F472-V556 HydrophobicContact CD1-CG1 3.56Å; F472-V556 HydrophobicContact CD1-CG2 4.34Å; F472-V556 HydrophobicContact CD2-CG1 4.39Å; F472-V556 HydrophobicContact CD2-CG2 4.25Å; F472-V556 HydrophobicContact CE1-CB 4.49Å; F472-V556 HydrophobicContact CE1-CG1 3.75Å; F472-V556 HydrophobicContact CE1-CG2 3.84Å; F472-V556 HydrophobicContact CE2-CG2 3.72Å; F472-V556 HydrophobicContact CG-CG1 3.9Å; F472-V556 HydrophobicContact CZ-CG1 4.23Å; F472-V556 HydrophobicContact CZ-CG2 3.49Å; F472-V556 VanDerWaalsContact CZ-CG2 3.49Å; R536-V556 PolarHBondContact NH2-O 2.91Å; R536-V556 VanDerWaalsContact NH2-O 3.08Å; F541-V556 HydrophobicContact CE2-CB 3.88Å; F541-V556 HydrophobicContact CE2-CG1 3.94Å; F541-V556 HydrophobicContact CE2-CG2 4.02Å; F541-V556 HydrophobicContact CZ-CB 4Å; F541-V556 HydrophobicContact CZ-CG2 3.94Å; N545-V556 WeakPolarHBondContact OD1-CG2 3.26Å; F554-V556 HydrophobicContact CD1-CG2 4.32Å; V556-F560 HydrophobicContact CG1-CB 3.88Å; V556-F560 HydrophobicContact CG1-CD1 3.66Å; V556-F560 HydrophobicContact CG1-CG 4.01Å
557	P	95.7	Very high	95.9	Very high	25 Å²	25	53.6 Å²	53.6	16%	0.162	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-64.4	148.3	179.4	-21.2	31.7	0	0	0	114	Y473 R559 F560	Y473-P557 HydrophobicContact CE1-CG 3.67Å; Y473-P557 WeakPolarHBondContact OH-CG 3.41Å; P557-R559 HydrophobicContact CB-CB 4.42Å; P557-R559 PolarHBondContact O-N 2.8Å; P557-F560 WeakPolarHBondContact O-CB 3.35Å; P557-F560 PolarHBondContact O-N 3.1Å
558	D	95.9	Very high	95.9	Very high	84 Å²	84	51.8 Å²	51.8	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-57.8	-35.7	173.6	-55.7	-79.4	0	0	0	112.5	R536 F560 L561 E562	R536-D558 IonicContact CZ-OD1 2.67Å; R536-D558 IonicContact NH1-OD1 3.84Å; R536-D558 PolarHBondContact NH1-OD1 3.44Å; R536-D558 VanDerWaalsContact NH2-CG 3.29Å; R536-D558 IonicContact NH2-OD1 3.64Å; R536-D558 PolarHBondContact NH2-OD1 3.29Å; R536-D558 IonicContact NH2-OD2 2.77Å; R536-D558 PolarHBondContact NH2-OD2 2.87Å; D558-F560 PolarHBondContact O-N 2.85Å; D558-F560 VanDerWaalsContact O-N 3.08Å; D558-L561 WeakPolarHBondContact O-CA 3.46Å; D558-L561 VanDerWaalsContact O-CB 3.29Å; D558-L561 WeakPolarHBondContact O-CB 3.32Å; D558-L561 PolarHBondContact O-N 3.27Å; D558-E562 PolarHBondContact O-N 3.37Å
559	R	96.6	Very high	95.9	Very high	113 Å²	113	53.2 Å²	53.2	43%	0.426	27%	0.266	S	S	.	.	H	α-helix	trans	-51.7	-31.6	172.5	-168	75.8	-162.8	-65.5	-11.6	113.2	P557 E562 V563 S598	P557-R559 HydrophobicContact CB-CB 4.42Å; P557-R559 PolarHBondContact O-N 2.8Å; R559-E562 WeakPolarHBondContact CD-OE2 3.37Å; R559-E562 IonicContact NE-OE2 3.28Å; R559-V563 WeakPolarHBondContact O-CB 3.17Å; R559-V563 WeakPolarHBondContact O-CG2 3.32Å; R559-V563 PolarHBondContact O-N 3.33Å; R559-S598 PolarHBondContact NH1-OG 2.87Å
560	F	97.7	Very high	96	Very high	5 Å²	5	56 Å²	56	2%	0.022	28%	0.279	C	S	.	.	H	α-helix	trans	-75.6	-33.3	175.2	178.2	-101.2	0	0	0	112.3	F472 Y510 L544 V556 P557 D558 V563 A564	F472-F560 HydrophobicContact CB-CB 4.48Å; F472-F560 HydrophobicContact CB-CD2 4.21Å; F472-F560 HydrophobicContact CB-CG 4.35Å; F472-F560 HydrophobicContact CD1-CB 4.49Å; F472-F560 AromaticContact CD1-CD1 3.67Å; F472-F560 HydrophobicContact CD1-CD1 3.67Å; F472-F560 AromaticContact CD1-CD2 3.75Å; F472-F560 HydrophobicContact CD1-CD2 3.75Å; F472-F560 AromaticContact CD1-CE1 3.69Å; F472-F560 HydrophobicContact CD1-CE1 3.69Å; F472-F560 AromaticContact CD1-CE2 3.75Å; F472-F560 HydrophobicContact CD1-CE2 3.75Å; F472-F560 AromaticContact CD1-CG 3.69Å; F472-F560 HydrophobicContact CD1-CG 3.69Å; F472-F560 AromaticContact CD1-CZ 3.71Å; F472-F560 HydrophobicContact CD1-CZ 3.71Å; F472-F560 HydrophobicContact CE1-CD1 4.07Å; F472-F560 AromaticContact CE1-CE1 3.77Å; F472-F560 HydrophobicContact CE1-CE1 3.77Å; F472-F560 HydrophobicContact CE1-CE2 4.45Å; F472-F560 AromaticContact CE1-CZ 3.96Å; F472-F560 HydrophobicContact CE1-CZ 3.96Å; F472-F560 HydrophobicContact CG-CD2 4.48Å; F472-F560 HydrophobicContact CG-CG 4.49Å; Y510-F560 HydrophobicContact CD2-CZ 4.41Å; Y510-F560 AromaticContact CE2-CE2 3.99Å; Y510-F560 HydrophobicContact CE2-CE2 3.99Å; Y510-F560 AromaticContact CE2-CZ 3.95Å; Y510-F560 HydrophobicContact CE2-CZ 3.95Å; L544-F560 HydrophobicContact CD1-CE1 4.16Å; L544-F560 HydrophobicContact CD1-CZ 4.12Å; V556-F560 HydrophobicContact CG1-CB 3.88Å; V556-F560 HydrophobicContact CG1-CD1 3.66Å; V556-F560 HydrophobicContact CG1-CG 4.01Å; P557-F560 WeakPolarHBondContact O-CB 3.35Å; P557-F560 PolarHBondContact O-N 3.1Å; D558-F560 PolarHBondContact O-N 2.85Å; D558-F560 VanDerWaalsContact O-N 3.08Å; F560-V563 PolarHBondContact O-N 3.43Å; F560-A564 WeakPolarHBondContact O-CB 3.35Å; F560-A564 PolarHBondContact O-N 3.05Å
561	L	97.2	Very high	96.3	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.079	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-51.1	177.4	-59.1	174.9	0	0	0	110.8	R536 F541 D558 V563 A564 E565	R536-L561 HydrophobicContact CG-CD1 3.64Å; F541-L561 HydrophobicContact CB-CD2 4.37Å; F541-L561 HydrophobicContact CD2-CD2 3.3Å; F541-L561 HydrophobicContact CE2-CD2 3.74Å; F541-L561 HydrophobicContact CG-CD2 3.94Å; D558-L561 WeakPolarHBondContact O-CA 3.46Å; D558-L561 VanDerWaalsContact O-CB 3.29Å; D558-L561 WeakPolarHBondContact O-CB 3.32Å; D558-L561 PolarHBondContact O-N 3.27Å; L561-V563 PolarHBondContact O-N 3.39Å; L561-A564 WeakPolarHBondContact O-CB 3.49Å; L561-A564 PolarHBondContact O-N 3.35Å; L561-A564 VanDerWaalsContact O-N 3.11Å; L561-E565 WeakPolarHBondContact O-CB 3.34Å; L561-E565 PolarHBondContact O-N 3.11Å
562	E	97.3	Very high	96.6	Very high	102 Å²	102	44.7 Å²	44.7	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-48.7	-46.4	172	-64.2	165.3	-165.9	0	0	111.4	D558 R559 E565 I566	D558-E562 PolarHBondContact O-N 3.37Å; R559-E562 WeakPolarHBondContact CD-OE2 3.37Å; R559-E562 IonicContact NE-OE2 3.28Å; E562-E565 PolarHBondContact O-N 3.25Å; E562-I566 WeakPolarHBondContact O-CD1 3.49Å; E562-I566 VanDerWaalsContact O-CG1 3.26Å; E562-I566 WeakPolarHBondContact O-CG1 3.41Å; E562-I566 PolarHBondContact O-N 3.49Å
563	V	98.1	Very high	96.9	Very high	6 Å²	6	42.3 Å²	42.3	4%	0.036	20%	0.204	C	C	.	.	H	α-helix	trans	-78.7	-26.2	-174	165.7	0	0	0	0	112.2	R475 Y510 R559 F560 L561 T567 L596	R475-V563 VanDerWaalsContact CZ-CG1 3.47Å; Y510-V563 PolarHBondContact OH-O 2.8Å; R559-V563 WeakPolarHBondContact O-CB 3.17Å; R559-V563 WeakPolarHBondContact O-CG2 3.32Å; R559-V563 PolarHBondContact O-N 3.33Å; F560-V563 PolarHBondContact O-N 3.43Å; L561-V563 PolarHBondContact O-N 3.39Å; V563-T567 WeakPolarHBondContact O-CB 3.26Å; V563-T567 PolarHBondContact O-N 3.02Å; V563-T567 VanDerWaalsContact O-N 3.16Å; V563-T567 PolarHBondContact O-OG1 3.28Å; V563-L596 HydrophobicContact CG1-CB 3.96Å; V563-L596 HydrophobicContact CG1-CD1 4.42Å; V563-L596 HydrophobicContact CG2-CB 4.11Å
564	A	98.3	Very high	97.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-71.6	-40	167.9	0	0	0	0	0	111.3	M514 V534 F560 L561 T567 L568	M514-A564 HydrophobicContact CE-CB 3.7Å; V534-A564 HydrophobicContact CG1-CB 3.98Å; F560-A564 WeakPolarHBondContact O-CB 3.35Å; F560-A564 PolarHBondContact O-N 3.05Å; L561-A564 WeakPolarHBondContact O-CB 3.49Å; L561-A564 PolarHBondContact O-N 3.35Å; L561-A564 VanDerWaalsContact O-N 3.11Å; A564-T567 WeakPolarHBondContact O-CB 3.33Å; A564-T567 PolarHBondContact O-N 2.81Å; A564-L568 WeakPolarHBondContact O-CB 3.45Å; A564-L568 PolarHBondContact O-N 3.49Å
565	E	98.2	Very high	97.3	Very high	54 Å²	54	38.9 Å²	38.9	25%	0.252	19%	0.187	S	C	.	.	H	α-helix	trans	-63.4	-52.5	175.1	-170.4	170.4	113.9	0	0	111.8	T533 V534 L561 E562 T567 L568 H569	T533-E565 WeakPolarHBondContact CA-OE2 3.48Å; T533-E565 WeakPolarHBondContact CB-OE2 3.2Å; V534-E565 HydrophobicContact CB-CB 3.99Å; V534-E565 HydrophobicContact CG2-CB 3.85Å; V534-E565 HydrophobicContact CG2-CG 4.24Å; V534-E565 PolarHBondContact N-OE2 3.28Å; L561-E565 WeakPolarHBondContact O-CB 3.34Å; L561-E565 PolarHBondContact O-N 3.11Å; E562-E565 PolarHBondContact O-N 3.25Å; E565-T567 PolarHBondContact O-N 3.49Å; E565-L568 WeakPolarHBondContact O-CB 3.42Å; E565-L568 PolarHBondContact O-N 3.46Å; E565-H569 WeakPolarHBondContact CG-NE2 3.5Å; E565-H569 PolarHBondContact O-CD2 3.45Å; E565-H569 VanDerWaalsContact O-CD2 3.32Å; E565-H569 VanDerWaalsContact O-CG 3.29Å; E565-H569 PolarHBondContact O-N 3.02Å; E565-H569 IonicContact OE1-CE1 2.64Å
566	I	98	Very high	97.4	Very high	67 Å²	67	35.2 Å²	35.2	34%	0.344	18%	0.177	S	C	.	.	H	α-helix	trans	-57.4	-35.9	174.4	-63.4	159.9	0	0	0	111.1	E562 E570 L596	E562-I566 WeakPolarHBondContact O-CD1 3.49Å; E562-I566 VanDerWaalsContact O-CG1 3.26Å; E562-I566 WeakPolarHBondContact O-CG1 3.41Å; E562-I566 PolarHBondContact O-N 3.49Å; I566-E570 WeakPolarHBondContact O-CG 3.4Å; I566-E570 PolarHBondContact O-N 2.91Å; I566-E570 VanDerWaalsContact O-N 3.08Å; I566-L596 HydrophobicContact CB-CD1 4.13Å; I566-L596 HydrophobicContact CD1-CD1 4.42Å; I566-L596 HydrophobicContact CD1-CD2 4.49Å; I566-L596 HydrophobicContact CG2-CD1 3.66Å
567	T	98.3	Very high	97.4	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-49.2	173.7	-61.1	0	0	0	0	111.4	Y510 M514 V563 A564 E565 H569 E570 F571 I593	Y510-T567 HydrophobicContact CE1-CG2 3.77Å; Y510-T567 PolarHBondContact OH-OG1 3.03Å; M514-T567 HydrophobicContact CB-CG2 3.93Å; M514-T567 HydrophobicContact CE-CG2 4.3Å; M514-T567 HydrophobicContact CG-CG2 3.45Å; M514-T567 VanDerWaalsContact CG-CG2 3.45Å; M514-T567 HydrophobicContact SD-CG2 3.7Å; V563-T567 WeakPolarHBondContact O-CB 3.26Å; V563-T567 PolarHBondContact O-N 3.02Å; V563-T567 VanDerWaalsContact O-N 3.16Å; V563-T567 PolarHBondContact O-OG1 3.28Å; A564-T567 WeakPolarHBondContact O-CB 3.33Å; A564-T567 PolarHBondContact O-N 2.81Å; E565-T567 PolarHBondContact O-N 3.49Å; T567-H569 VanDerWaalsContact C-N 3.3Å; T567-H569 PolarHBondContact O-N 3.12Å; T567-E570 PolarHBondContact O-N 3.35Å; T567-F571 HydrophobicContact CG2-CD2 3.87Å; T567-F571 HydrophobicContact CG2-CE2 3.98Å; T567-F571 WeakPolarHBondContact O-CD2 3.47Å; T567-F571 PolarHBondContact O-N 2.97Å; T567-I593 HydrophobicContact CG2-CD1 3.52Å; T567-I593 HydrophobicContact CG2-CG1 4.34Å
568	L	98.5	Very high	97.4	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-39.3	-178.6	-175.2	62.4	0	0	0	111.3	M514 F517 A518 I532 V534 L540 A564 E565 F571 Y572	M514-L568 WeakPolarHBondContact O-CD1 3.43Å; M514-L568 HydrophobicContact SD-CB 4.01Å; M514-L568 HydrophobicContact SD-CD1 4.44Å; F517-L568 HydrophobicContact CB-CD1 3.82Å; A518-L568 HydrophobicContact CB-CD1 4.08Å; I532-L568 HydrophobicContact CG2-CD2 3.32Å; I532-L568 HydrophobicContact CG2-CG 3.88Å; V534-L568 HydrophobicContact CG2-CB 4.46Å; V534-L568 HydrophobicContact CG2-CD2 3.74Å; L540-L568 HydrophobicContact CD2-CB 4.46Å; L540-L568 HydrophobicContact CD2-CD1 4.33Å; L540-L568 HydrophobicContact CD2-CD2 3.75Å; L540-L568 HydrophobicContact CD2-CG 4.42Å; A564-L568 WeakPolarHBondContact O-CB 3.45Å; A564-L568 PolarHBondContact O-N 3.49Å; E565-L568 WeakPolarHBondContact O-CB 3.42Å; E565-L568 PolarHBondContact O-N 3.46Å; L568-F571 PolarHBondContact O-N 3.31Å; L568-Y572 WeakPolarHBondContact O-CB 3.19Å; L568-Y572 PolarHBondContact O-N 2.91Å
569	H	98.3	Very high	97.3	Very high	36 Å²	36	42 Å²	42	17%	0.167	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-47.7	172.8	-67.6	-175.9	0	0	0	112.2	V529 I532 E565 T567 F571 Y572 N573	V529-H569 HydrophobicContact CG2-CB 3.61Å; V529-H569 VanDerWaalsContact CG2-CG 3.49Å; V529-H569 PolarHBondContact O-NE2 3.32Å; I532-H569 PolarHBondContact O-NE2 3.04Å; E565-H569 WeakPolarHBondContact CG-NE2 3.5Å; E565-H569 PolarHBondContact O-CD2 3.45Å; E565-H569 VanDerWaalsContact O-CD2 3.32Å; E565-H569 VanDerWaalsContact O-CG 3.29Å; E565-H569 PolarHBondContact O-N 3.02Å; E565-H569 IonicContact OE1-CE1 2.64Å; T567-H569 VanDerWaalsContact C-N 3.3Å; T567-H569 PolarHBondContact O-N 3.12Å; H569-F571 VanDerWaalsContact C-N 3.33Å; H569-F571 PolarHBondContact O-N 3.46Å; H569-Y572 PolarHBondContact O-N 3.42Å; H569-N573 VanDerWaalsContact O-CB 3.24Å; H569-N573 WeakPolarHBondContact O-CB 3.21Å; H569-N573 PolarHBondContact O-N 3.22Å; H569-N573 PolarHBondContact O-ND2 3.44Å; H569-N573 VanDerWaalsContact O-ND2 3.16Å
570	E	98.1	Very high	97.2	Very high	62 Å²	62	38.5 Å²	38.5	29%	0.29	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-38.1	176.9	-79.3	-74	125.4	0	0	112.5	I566 T567 A574 I589 V592	I566-E570 WeakPolarHBondContact O-CG 3.4Å; I566-E570 PolarHBondContact O-N 2.91Å; I566-E570 VanDerWaalsContact O-N 3.08Å; T567-E570 PolarHBondContact O-N 3.35Å; E570-A574 WeakPolarHBondContact O-CB 3.3Å; E570-A574 PolarHBondContact O-N 3.01Å; E570-I589 HydrophobicContact CB-CB 4.45Å; E570-I589 HydrophobicContact CB-CG1 4.18Å; E570-I589 HydrophobicContact CB-CG2 3.8Å; E570-V592 HydrophobicContact CG-CG1 4.27Å
571	F	98.3	Very high	97	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-47.7	173.1	-89.4	-95.7	0	0	0	111.9	Y511 M514 E515 A518 T567 L568 H569 A574 I575 W585 K586 I589 Y590 I593	Y511-F571 AromaticContact CD1-CE2 3.96Å; Y511-F571 HydrophobicContact CD1-CE2 3.96Å; Y511-F571 HydrophobicContact CD1-CZ 4.01Å; Y511-F571 HydrophobicContact CG-CZ 4.2Å; M514-F571 HydrophobicContact CB-CD2 3.82Å; M514-F571 HydrophobicContact CB-CE2 4Å; M514-F571 HydrophobicContact CB-CG 4.15Å; M514-F571 HydrophobicContact CB-CZ 4.48Å; E515-F571 HydrophobicContact CB-CD1 3.88Å; E515-F571 HydrophobicContact CB-CE1 3.91Å; E515-F571 HydrophobicContact CG-CD1 4.47Å; A518-F571 HydrophobicContact CB-CB 3.79Å; T567-F571 HydrophobicContact CG2-CD2 3.87Å; T567-F571 HydrophobicContact CG2-CE2 3.98Å; T567-F571 WeakPolarHBondContact O-CD2 3.47Å; T567-F571 PolarHBondContact O-N 2.97Å; L568-F571 PolarHBondContact O-N 3.31Å; H569-F571 VanDerWaalsContact C-N 3.33Å; H569-F571 PolarHBondContact O-N 3.46Å; F571-A574 PolarHBondContact O-N 3.35Å; F571-I575 WeakPolarHBondContact O-CD1 3.33Å; F571-I575 WeakPolarHBondContact O-CG1 3.48Å; F571-I575 PolarHBondContact O-N 2.89Å; F571-I575 VanDerWaalsContact O-N 3.09Å; F571-W585 AromaticContact CD1-CH2 3.63Å; F571-W585 HydrophobicContact CD1-CH2 3.63Å; F571-W585 AromaticContact CD1-CZ3 3.74Å; F571-W585 HydrophobicContact CD1-CZ3 3.74Å; F571-W585 AromaticContact CE1-CH2 3.85Å; F571-W585 HydrophobicContact CE1-CH2 3.85Å; F571-W585 HydrophobicContact CE1-CZ3 4.06Å; F571-W585 HydrophobicContact CG-CZ3 4.5Å; F571-K586 HydrophobicContact CE1-CD 4.28Å; F571-I589 HydrophobicContact CD1-CD1 4.39Å; F571-I589 HydrophobicContact CD2-CD1 4.19Å; F571-I589 HydrophobicContact CD2-CG2 3.78Å; F571-I589 HydrophobicContact CE2-CD1 4.42Å; F571-I589 HydrophobicContact CE2-CG2 3.61Å; F571-I589 HydrophobicContact CG-CD1 4.18Å; F571-I589 HydrophobicContact CZ-CG2 4.46Å; F571-Y590 HydrophobicContact CZ-CE1 4.43Å; F571-I593 HydrophobicContact CE2-CD1 4.4Å
572	Y	98.3	Very high	96.9	Very high	13 Å²	13	47.4 Å²	47.4	5%	0.051	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-50.8	177.4	174.7	-92	0	0	0	111.6	A521 I522 V526 R527 V529 I532 L568 H569 A574 I575 S576	A521-Y572 HydrophobicContact CB-CD2 4.4Å; I522-Y572 HydrophobicContact CD1-CD2 3.97Å; I522-Y572 HydrophobicContact CD1-CE2 4.21Å; I522-Y572 HydrophobicContact CG1-CD2 3.55Å; I522-Y572 HydrophobicContact CG1-CE2 3.4Å; I522-Y572 VanDerWaalsContact CG1-CE2 3.4Å; V526-Y572 PolarHBondContact O-OH 3.36Å; R527-Y572 PolarHBondContact O-OH 3.37Å; V529-Y572 HydrophobicContact CB-CD1 3.83Å; V529-Y572 HydrophobicContact CB-CE1 3.9Å; V529-Y572 HydrophobicContact CG2-CD1 3.69Å; V529-Y572 HydrophobicContact CG2-CE1 4.28Å; V529-Y572 HydrophobicContact CG2-CG 4.44Å; I532-Y572 HydrophobicContact CD1-CD1 4.07Å; I532-Y572 HydrophobicContact CD1-CD2 3.35Å; I532-Y572 HydrophobicContact CD1-CE1 4.31Å; I532-Y572 HydrophobicContact CD1-CE2 3.63Å; I532-Y572 HydrophobicContact CD1-CG 3.6Å; L568-Y572 WeakPolarHBondContact O-CB 3.19Å; L568-Y572 PolarHBondContact O-N 2.91Å; H569-Y572 PolarHBondContact O-N 3.42Å; Y572-A574 PolarHBondContact O-N 3.46Å; Y572-I575 PolarHBondContact O-N 2.93Å; Y572-I575 VanDerWaalsContact O-N 3.16Å; Y572-S576 WeakPolarHBondContact O-CB 3.29Å; Y572-S576 PolarHBondContact O-N 2.82Å; Y572-S576 PolarHBondContact O-OG 2.92Å
573	N	97.1	Very high	96.8	Very high	62 Å²	62	49 Å²	49	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-65.1	-18.1	179.9	-70.8	-28.1	0	0	0	114.4	H569 A577 K579	H569-N573 VanDerWaalsContact O-CB 3.24Å; H569-N573 WeakPolarHBondContact O-CB 3.21Å; H569-N573 PolarHBondContact O-N 3.22Å; H569-N573 PolarHBondContact O-ND2 3.44Å; H569-N573 VanDerWaalsContact O-ND2 3.16Å; N573-A577 WeakPolarHBondContact O-CB 3.35Å; N573-K579 PolarHBondContact O-NZ 3.42Å
574	A	97.3	Very high	96.7	Very high	9 Å²	9	52.1 Å²	52.1	7%	0.074	31%	0.306	C	S	.	.	H	α-helix	trans	-83.2	-46.1	171.3	0	0	0	0	0	111.7	E570 F571 Y572 A577 T578 K579 W585 I589	E570-A574 WeakPolarHBondContact O-CB 3.3Å; E570-A574 PolarHBondContact O-N 3.01Å; F571-A574 PolarHBondContact O-N 3.35Å; Y572-A574 PolarHBondContact O-N 3.46Å; A574-A577 CarbonylContact O-C 3.56Å; A574-T578 PolarHBondContact O-N 2.99Å; A574-K579 WeakPolarHBondContact O-CB 3.36Å; A574-K579 PolarHBondContact O-N 2.91Å; A574-W585 HydrophobicContact CB-CE3 3.68Å; A574-W585 HydrophobicContact CB-CZ3 3.82Å; A574-I589 HydrophobicContact CB-CD1 3.97Å
575	I	97	Very high	96.6	Very high	15 Å²	15	53.9 Å²	53.9	8%	0.077	31%	0.313	C	S	.	.	H	α-helix	trans	-74.8	-41.8	-176.4	-61	159	0	0	0	111.6	E515 A518 R519 I522 F571 Y572 A577 T578 D580 W585	E515-I575 HydrophobicContact CG-CD1 4.27Å; A518-I575 HydrophobicContact CB-CD1 3.89Å; R519-I575 HydrophobicContact CG-CD1 3.83Å; R519-I575 HydrophobicContact CG-CG2 4.35Å; I522-I575 HydrophobicContact CD1-CB 3.75Å; I522-I575 HydrophobicContact CD1-CG2 3.53Å; F571-I575 WeakPolarHBondContact O-CD1 3.33Å; F571-I575 WeakPolarHBondContact O-CG1 3.48Å; F571-I575 PolarHBondContact O-N 2.89Å; F571-I575 VanDerWaalsContact O-N 3.09Å; Y572-I575 PolarHBondContact O-N 2.93Å; Y572-I575 VanDerWaalsContact O-N 3.16Å; I575-A577 PolarHBondContact O-N 3.3Å; I575-T578 WeakPolarHBondContact O-CA 3.45Å; I575-T578 PolarHBondContact O-N 3.1Å; I575-D580 HydrophobicContact CG1-CB 3.96Å; I575-W585 HydrophobicContact CD1-CH2 3.9Å; I575-W585 HydrophobicContact CD1-CZ3 4.42Å; I575-W585 HydrophobicContact CG1-CH2 3.76Å; I575-W585 HydrophobicContact CG1-CZ3 4.04Å
576	S	96.1	Very high	96.5	Very high	59 Å²	59	53.6 Å²	53.6	41%	0.413	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-27.8	176.7	64.8	0	0	0	0	112.4	Y572 T578	Y572-S576 WeakPolarHBondContact O-CB 3.29Å; Y572-S576 PolarHBondContact O-N 2.82Å; Y572-S576 PolarHBondContact O-OG 2.92Å; S576-T578 VanDerWaalsContact C-N 3.33Å
577	A	95.4	Very high	96.4	Very high	43 Å²	43	57.1 Å²	57.1	36%	0.355	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	13.8	171.7	0	0	0	0	0	113.8	N573 A574 I575 K579	N573-A577 WeakPolarHBondContact O-CB 3.35Å; A574-A577 CarbonylContact O-C 3.56Å; I575-A577 PolarHBondContact O-N 3.3Å; A577-K579 HydrophobicContact CB-CD 4.15Å; A577-K579 HydrophobicContact CB-CG 4.13Å; A577-K579 PolarHBondContact O-N 3.46Å
578	T	95.1	Very high	96.3	Very high	102 Å²	102	60 Å²	60	63%	0.626	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	18	179.3	64.7	0	0	0	0	116.7	A574 I575 S576 D580 S581	A574-T578 PolarHBondContact O-N 2.99Å; I575-T578 WeakPolarHBondContact O-CA 3.45Å; I575-T578 PolarHBondContact O-N 3.1Å; S576-T578 VanDerWaalsContact C-N 3.33Å; T578-D580 PolarHBondContact O-N 3.44Å; T578-S581 PolarHBondContact O-N 2.82Å; T578-S581 PolarHBondContact O-OG 3.45Å
579	K	94.3	Very high	96.3	Very high	110 Å²	110	59.8 Å²	59.8	48%	0.478	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-70.1	-14.9	178.8	-58.4	170.5	-168.7	139.7	0	112.1	N573 A574 A577 S581 D582 W585	N573-K579 PolarHBondContact O-NZ 3.42Å; A574-K579 WeakPolarHBondContact O-CB 3.36Å; A574-K579 PolarHBondContact O-N 2.91Å; A577-K579 HydrophobicContact CB-CD 4.15Å; A577-K579 HydrophobicContact CB-CG 4.13Å; A577-K579 PolarHBondContact O-N 3.46Å; K579-S581 PolarHBondContact O-N 2.76Å; K579-D582 WeakPolarHBondContact O-CB 3.45Å; K579-D582 PolarHBondContact O-N 3.46Å; K579-W585 WeakPolarHBondContact O-CB 3.37Å
580	D	93.6	Very high	96.2	Very high	41 Å²	41	61.8 Å²	61.8	22%	0.219	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-67.3	-11.1	177.8	66	-47.7	0	0	0	114.1	R519 I575 T578 D582 W585	R519-D580 IonicContact CZ-OD2 2.72Å; R519-D580 IonicContact NH1-OD2 2.61Å; R519-D580 PolarHBondContact NH1-OD2 3.07Å; R519-D580 IonicContact NH2-OD2 2.66Å; R519-D580 PolarHBondContact NH2-OD2 2.95Å; I575-D580 HydrophobicContact CG1-CB 3.96Å; T578-D580 PolarHBondContact O-N 3.44Å; D580-D582 VanDerWaalsContact C-N 3.35Å; D580-W585 HydrophobicContact CB-CD2 3.84Å; D580-W585 VanDerWaalsContact CB-CE2 3.49Å; D580-W585 HydrophobicContact CB-CE3 4.25Å; D580-W585 HydrophobicContact CB-CG 4.3Å; D580-W585 HydrophobicContact CB-CH2 4.05Å; D580-W585 HydrophobicContact CB-CZ2 3.61Å; D580-W585 HydrophobicContact CB-CZ3 4.36Å; D580-W585 PolarHBondContact O-NE1 2.84Å
581	S	94.1	Very high	96.1	Very high	102 Å²	102	65.7 Å²	65.7	71%	0.713	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-67.9	-26.8	166	60.2	0	0	0	0	114.1	T578 K579	T578-S581 PolarHBondContact O-N 2.82Å; T578-S581 PolarHBondContact O-OG 3.45Å; K579-S581 PolarHBondContact O-N 2.76Å
582	D	95	Very high	96	Very high	104 Å²	104	68 Å²	68	56%	0.556	38%	0.384	S	S	*	.	S	Bend	trans	-75.6	123.9	177.8	-88.2	-44.5	0	0	0	111.3	K579 D580 S584 W585	K579-D582 WeakPolarHBondContact O-CB 3.45Å; K579-D582 PolarHBondContact O-N 3.46Å; D580-D582 VanDerWaalsContact C-N 3.35Å; D582-S584 PolarHBondContact O-N 2.91Å; D582-W585 HydrophobicContact CB-CB 4.48Å; D582-W585 WeakPolarHBondContact O-CB 3.41Å; D582-W585 PolarHBondContact O-N 3.35Å
583	S	94.9	Very high	95.9	Very high	135 Å²	135	67.4 Å²	67.4	94%	0.944	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-10.1	-179.1	65	0	0	0	0	116.5
584	S	96.3	Very high	95.8	Very high	72 Å²	72	67.3 Å²	67.3	50%	0.503	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	8.8	177.9	74.9	0	0	0	0	115.5	D582 K586 K587	D582-S584 PolarHBondContact O-N 2.91Å; S584-K586 PolarHBondContact O-N 3.06Å; S584-K587 WeakPolarHBondContact O-CB 3.45Å; S584-K587 PolarHBondContact O-N 2.97Å
585	W	96.3	Very high	95.7	Very high	37 Å²	37	75.5 Å²	75.5	14%	0.14	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-49.8	-171.8	71.8	-90.7	0	0	0	114.7	E515 F571 A574 I575 K579 D580 D582 K587 A588 I589	E515-W585 HydrophobicContact CG-CH2 4.39Å; F571-W585 AromaticContact CD1-CH2 3.63Å; F571-W585 HydrophobicContact CD1-CH2 3.63Å; F571-W585 AromaticContact CD1-CZ3 3.74Å; F571-W585 HydrophobicContact CD1-CZ3 3.74Å; F571-W585 AromaticContact CE1-CH2 3.85Å; F571-W585 HydrophobicContact CE1-CH2 3.85Å; F571-W585 HydrophobicContact CE1-CZ3 4.06Å; F571-W585 HydrophobicContact CG-CZ3 4.5Å; A574-W585 HydrophobicContact CB-CE3 3.68Å; A574-W585 HydrophobicContact CB-CZ3 3.82Å; I575-W585 HydrophobicContact CD1-CH2 3.9Å; I575-W585 HydrophobicContact CD1-CZ3 4.42Å; I575-W585 HydrophobicContact CG1-CH2 3.76Å; I575-W585 HydrophobicContact CG1-CZ3 4.04Å; K579-W585 WeakPolarHBondContact O-CB 3.37Å; D580-W585 HydrophobicContact CB-CD2 3.84Å; D580-W585 VanDerWaalsContact CB-CE2 3.49Å; D580-W585 HydrophobicContact CB-CE3 4.25Å; D580-W585 HydrophobicContact CB-CG 4.3Å; D580-W585 HydrophobicContact CB-CH2 4.05Å; D580-W585 HydrophobicContact CB-CZ2 3.61Å; D580-W585 HydrophobicContact CB-CZ3 4.36Å; D580-W585 PolarHBondContact O-NE1 2.84Å; D582-W585 HydrophobicContact CB-CB 4.48Å; D582-W585 WeakPolarHBondContact O-CB 3.41Å; D582-W585 PolarHBondContact O-N 3.35Å; W585-K587 PolarHBondContact O-N 2.83Å; W585-A588 PolarHBondContact O-N 3.12Å; W585-I589 HydrophobicContact CE3-CD1 3.58Å; W585-I589 HydrophobicContact CZ3-CD1 3.57Å
586	K	96.4	Very high	95.6	Very high	49 Å²	49	76.3 Å²	76.3	21%	0.213	42%	0.423	C	S	.	.	H	α-helix	trans	-61	-16.5	179.7	-54.6	-172.7	-179	-179.2	0	114	E515 F571 S584 A588 I589 Y590	E515-K586 VanDerWaalsContact OE2-CE 3.31Å; E515-K586 WeakPolarHBondContact OE2-CE 3.38Å; E515-K586 IonicContact OE2-NZ 2.64Å; E515-K586 PolarHBondContact OE2-NZ 3.26Å; F571-K586 HydrophobicContact CE1-CD 4.28Å; S584-K586 PolarHBondContact O-N 3.06Å; K586-A588 VanDerWaalsContact C-N 3.28Å; K586-A588 PolarHBondContact O-N 3.17Å; K586-I589 PolarHBondContact O-N 3.03Å; K586-Y590 HydrophobicContact CB-CD1 4.35Å; K586-Y590 HydrophobicContact CB-CD2 4.4Å; K586-Y590 HydrophobicContact CB-CE1 3.81Å; K586-Y590 HydrophobicContact CB-CE2 3.89Å; K586-Y590 HydrophobicContact CD-CE1 4.43Å; K586-Y590 WeakPolarHBondContact CD-OH 3.31Å; K586-Y590 WeakPolarHBondContact O-CB 3.47Å; K586-Y590 WeakPolarHBondContact O-CD1 3.44Å; K586-Y590 WeakPolarHBondContact O-CD2 3.4Å; K586-Y590 PolarHBondContact O-N 3.37Å
587	K	96.2	Very high	95.5	Very high	140 Å²	140	75.2 Å²	75.2	61%	0.609	41%	0.412	S	S	*	.	H	α-helix	trans	-66.8	-25.8	179.2	-168.4	179.9	-179.2	-179.6	0	113.1	S584 W585 K591	S584-K587 WeakPolarHBondContact O-CB 3.45Å; S584-K587 PolarHBondContact O-N 2.97Å; W585-K587 PolarHBondContact O-N 2.83Å; K587-K591 WeakPolarHBondContact O-CG 3.5Å
588	A	95.9	Very high	95.2	Very high	62 Å²	62	74.4 Å²	74.4	51%	0.512	40%	0.404	S	S	.	.	H	α-helix	trans	-72.9	-54.6	170.4	0	0	0	0	0	110	W585 K586 Y590 K591 V592	W585-A588 PolarHBondContact O-N 3.12Å; K586-A588 VanDerWaalsContact C-N 3.28Å; K586-A588 PolarHBondContact O-N 3.17Å; A588-Y590 VanDerWaalsContact C-N 3.35Å; A588-Y590 PolarHBondContact O-N 2.88Å; A588-K591 WeakPolarHBondContact O-CA 3.44Å; A588-K591 WeakPolarHBondContact O-CB 3.39Å; A588-K591 PolarHBondContact O-N 3.36Å; A588-V592 PolarHBondContact O-N 3.24Å
589	I	97.4	Very high	95	Very high	3 Å²	3	78.3 Å²	78.3	2%	0.015	42%	0.416	C	S	.	.	H	α-helix	trans	-53.7	-48.4	179.9	-54.8	172.9	0	0	0	111.3	E570 F571 A574 W585 K586 K591 V592 I593	E570-I589 HydrophobicContact CB-CB 4.45Å; E570-I589 HydrophobicContact CB-CG1 4.18Å; E570-I589 HydrophobicContact CB-CG2 3.8Å; F571-I589 HydrophobicContact CD1-CD1 4.39Å; F571-I589 HydrophobicContact CD2-CD1 4.19Å; F571-I589 HydrophobicContact CD2-CG2 3.78Å; F571-I589 HydrophobicContact CE2-CD1 4.42Å; F571-I589 HydrophobicContact CE2-CG2 3.61Å; F571-I589 HydrophobicContact CG-CD1 4.18Å; F571-I589 HydrophobicContact CZ-CG2 4.46Å; A574-I589 HydrophobicContact CB-CD1 3.97Å; W585-I589 HydrophobicContact CE3-CD1 3.58Å; W585-I589 HydrophobicContact CZ3-CD1 3.57Å; K586-I589 PolarHBondContact O-N 3.03Å; I589-K591 PolarHBondContact O-N 2.88Å; I589-K591 VanDerWaalsContact O-N 3.16Å; I589-V592 WeakPolarHBondContact O-CB 3.29Å; I589-V592 PolarHBondContact O-N 3.24Å; I589-I593 HydrophobicContact CG2-CD1 3.49Å; I589-I593 VanDerWaalsContact CG2-CD1 3.49Å; I589-I593 HydrophobicContact CG2-CG1 4.18Å; I589-I593 VanDerWaalsContact O-CG1 3.3Å; I589-I593 WeakPolarHBondContact O-CG1 3.36Å; I589-I593 PolarHBondContact O-N 3.41Å
590	Y	96.9	Very high	94.9	Very high	77 Å²	77	73.6 Å²	73.6	30%	0.302	40%	0.395	S	S	.	.	H	α-helix	trans	-60.7	-26.4	177.6	-62.9	-12.3	0	0	0	113.8	Y511 F571 K586 A588 C594	Y511-Y590 HydrophobicContact CD1-CD1 4.48Å; Y511-Y590 AromaticContact CD1-CE1 3.98Å; Y511-Y590 HydrophobicContact CD1-CE1 3.98Å; Y511-Y590 HydrophobicContact CD2-CD1 4.11Å; Y511-Y590 AromaticContact CD2-CE1 3.28Å; Y511-Y590 HydrophobicContact CD2-CE1 3.28Å; Y511-Y590 AromaticContact CD2-CZ 3.6Å; Y511-Y590 HydrophobicContact CE1-CD1 4.07Å; Y511-Y590 AromaticContact CE1-CE1 4Å; Y511-Y590 HydrophobicContact CE1-CE1 4Å; Y511-Y590 AromaticContact CE2-CD1 3.6Å; Y511-Y590 HydrophobicContact CE2-CD1 3.6Å; Y511-Y590 AromaticContact CE2-CE1 3.24Å; Y511-Y590 HydrophobicContact CE2-CE1 3.24Å; Y511-Y590 HydrophobicContact CE2-CE2 4.46Å; Y511-Y590 HydrophobicContact CE2-CG 4.37Å; Y511-Y590 AromaticContact CE2-CZ 3.73Å; Y511-Y590 AromaticContact CG-CE1 3.68Å; Y511-Y590 HydrophobicContact CG-CE1 3.68Å; Y511-Y590 AromaticContact CZ-CD1 3.6Å; Y511-Y590 AromaticContact CZ-CE1 3.64Å; F571-Y590 HydrophobicContact CZ-CE1 4.43Å; K586-Y590 HydrophobicContact CB-CD1 4.35Å; K586-Y590 HydrophobicContact CB-CD2 4.4Å; K586-Y590 HydrophobicContact CB-CE1 3.81Å; K586-Y590 HydrophobicContact CB-CE2 3.89Å; K586-Y590 HydrophobicContact CD-CE1 4.43Å; K586-Y590 WeakPolarHBondContact CD-OH 3.31Å; K586-Y590 WeakPolarHBondContact O-CB 3.47Å; K586-Y590 WeakPolarHBondContact O-CD1 3.44Å; K586-Y590 WeakPolarHBondContact O-CD2 3.4Å; K586-Y590 PolarHBondContact O-N 3.37Å; A588-Y590 VanDerWaalsContact C-N 3.35Å; A588-Y590 PolarHBondContact O-N 2.88Å; Y590-C594 WeakPolarHBondContact O-CB 3.36Å; Y590-C594 PolarHBondContact O-N 3.34Å; Y590-C594 VanDerWaalsContact O-N 3.1Å
591	K	95.9	Very high	94.8	Very high	145 Å²	145	73.5 Å²	73.5	63%	0.63	40%	0.397	S	S	*	.	H	α-helix	trans	-77.2	-30.6	173.8	-74.9	175.7	172	-172.4	0	112.8	K587 A588 I589 K595	K587-K591 WeakPolarHBondContact O-CG 3.5Å; A588-K591 WeakPolarHBondContact O-CA 3.44Å; A588-K591 WeakPolarHBondContact O-CB 3.39Å; A588-K591 PolarHBondContact O-N 3.36Å; I589-K591 PolarHBondContact O-N 2.88Å; I589-K591 VanDerWaalsContact O-N 3.16Å; K591-K595 WeakPolarHBondContact O-CG 3.48Å
592	V	96.8	Very high	94.6	Very high	48 Å²	48	74.4 Å²	74.4	29%	0.291	39%	0.39	S	S	.	.	H	α-helix	trans	-68.5	-54.6	172.2	179	0	0	0	0	108.4	E570 A588 I589 C594 K595 L596	E570-V592 HydrophobicContact CG-CG1 4.27Å; A588-V592 PolarHBondContact O-N 3.24Å; I589-V592 WeakPolarHBondContact O-CB 3.29Å; I589-V592 PolarHBondContact O-N 3.24Å; V592-C594 VanDerWaalsContact C-N 3.32Å; V592-C594 PolarHBondContact O-N 3.49Å; V592-K595 WeakPolarHBondContact O-CB 3.36Å; V592-K595 PolarHBondContact O-N 3.5Å; V592-L596 HydrophobicContact CG1-CD1 4.24Å; V592-L596 PolarHBondContact O-N 3.46Å
593	I	96.1	Very high	94.2	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-56.6	-41.8	-178.1	-65.3	175.7	0	0	0	112.5	R475 Y476 Y511 T567 F571 I589 K595 L596	R475-I593 PolarHBondContact NH2-O 2.84Å; R475-I593 VanDerWaalsContact NH2-O 3.13Å; Y476-I593 HydrophobicContact CE2-CG2 4.2Å; Y511-I593 HydrophobicContact CD1-CD1 4.33Å; Y511-I593 HydrophobicContact CE1-CD1 3.58Å; Y511-I593 HydrophobicContact CE1-CG2 4.24Å; T567-I593 HydrophobicContact CG2-CD1 3.52Å; T567-I593 HydrophobicContact CG2-CG1 4.34Å; F571-I593 HydrophobicContact CE2-CD1 4.4Å; I589-I593 HydrophobicContact CG2-CD1 3.49Å; I589-I593 VanDerWaalsContact CG2-CD1 3.49Å; I589-I593 HydrophobicContact CG2-CG1 4.18Å; I589-I593 VanDerWaalsContact O-CG1 3.3Å; I589-I593 WeakPolarHBondContact O-CG1 3.36Å; I589-I593 PolarHBondContact O-N 3.41Å; I593-K595 PolarHBondContact O-N 3.07Å; I593-L596 PolarHBondContact O-N 3.24Å
594	C	94.6	Very high	93.8	Very high	60 Å²	60	67.9 Å²	67.9	41%	0.405	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.2	177.1	-171.1	0	0	0	0	113.6	Y476 Y590 V592	Y476-C594 HydrophobicContact CD2-CB 4.14Å; Y476-C594 HydrophobicContact CE2-CB 4.18Å; Y476-C594 HydrophobicContact CG-CB 4.36Å; Y590-C594 WeakPolarHBondContact O-CB 3.36Å; Y590-C594 PolarHBondContact O-N 3.34Å; Y590-C594 VanDerWaalsContact O-N 3.1Å; V592-C594 VanDerWaalsContact C-N 3.32Å; V592-C594 PolarHBondContact O-N 3.49Å
595	K	95.5	Very high	93.3	Very high	180 Å²	180	67.5 Å²	67.5	78%	0.783	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.2	175	-64.2	175.8	176.5	-172.9	0	113.9	K591 V592 I593	K591-K595 WeakPolarHBondContact O-CG 3.48Å; V592-K595 WeakPolarHBondContact O-CB 3.36Å; V592-K595 PolarHBondContact O-N 3.5Å; I593-K595 PolarHBondContact O-N 3.07Å
596	L	94.8	Very high	92.5	Very high	33 Å²	33	68.8 Å²	68.8	17%	0.173	34%	0.342	C	S	.	.	S	Bend	trans	-93.9	4.7	-177.4	-64.2	175.7	0	0	0	112.8	R475 V563 I566 V592 I593	R475-L596 PolarHBondContact NH2-O 3.02Å; R475-L596 VanDerWaalsContact NH2-O 3.09Å; V563-L596 HydrophobicContact CG1-CB 3.96Å; V563-L596 HydrophobicContact CG1-CD1 4.42Å; V563-L596 HydrophobicContact CG2-CB 4.11Å; I566-L596 HydrophobicContact CB-CD1 4.13Å; I566-L596 HydrophobicContact CD1-CD1 4.42Å; I566-L596 HydrophobicContact CD1-CD2 4.49Å; I566-L596 HydrophobicContact CG2-CD1 3.66Å; V592-L596 HydrophobicContact CG1-CD1 4.24Å; V592-L596 PolarHBondContact O-N 3.46Å; I593-L596 PolarHBondContact O-N 3.24Å
597	D	93.1	Very high	90.8	Very high	35 Å²	35	70.1 Å²	70.1	19%	0.187	36%	0.358	C	S	.	.			trans	-67.8	151.3	174	-84.1	10.7	0	0	0	110.9	T474 R475 Y476	T474-D597 VanDerWaalsContact CA-OD2 3.31Å; T474-D597 WeakPolarHBondContact CA-OD2 3.44Å; T474-D597 WeakPolarHBondContact CB-OD2 3.5Å; T474-D597 PolarHBondContact OG1-OD2 3.15Å; R475-D597 IonicContact CZ-OD1 2.6Å; R475-D597 VanDerWaalsContact CZ-OD1 3.22Å; R475-D597 VanDerWaalsContact N-CG 3.32Å; R475-D597 PolarHBondContact N-OD1 2.87Å; R475-D597 VanDerWaalsContact N-OD1 3.13Å; R475-D597 PolarHBondContact N-OD2 3.23Å; R475-D597 IonicContact NE-OD1 2.76Å; R475-D597 PolarHBondContact NE-OD1 3.43Å; R475-D597 IonicContact NH2-OD1 3.83Å; R475-D597 PolarHBondContact NH2-OD1 3.26Å; Y476-D597 PolarHBondContact N-OD2 3.01Å
598	S	89.6	Confident	89	Confident	26 Å²	26	68.3 Å²	68.3	18%	0.182	36%	0.363	C	S	.	.			trans	-113.6	160.5	-176.8	-55.7	0	0	0	0	111	Y473 R559	Y473-S598 PolarHBondContact O-N 3.45Å; R559-S598 PolarHBondContact NH1-OG 2.87Å
599	E	90.7	Very high	87.2	Confident	185 Å²	185	68.6 Å²	68.6	86%	0.864	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-62.9	144	162.1	-60.7	-167.8	157.3	0	0	109.8
600	I	92.6	Very high	85.1	Confident	11 Å²	11	73.5 Å²	73.5	6%	0.056	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-90.6	130.5	179.8	-45.3	178.3	0	0	0	107.6	M470 Y473 T474 V481 F485 F604	M470-I600 HydrophobicContact CB-CD1 4.39Å; M470-I600 HydrophobicContact CE-CD1 3.44Å; M470-I600 VanDerWaalsContact CE-CD1 3.44Å; M470-I600 HydrophobicContact CG-CD1 4.33Å; M470-I600 HydrophobicContact CG-CG2 4.23Å; Y473-I600 HydrophobicContact CD2-CG2 4.29Å; T474-I600 HydrophobicContact CG2-CD1 3.51Å; T474-I600 HydrophobicContact CG2-CG1 3.78Å; V481-I600 HydrophobicContact CG1-CD1 3.73Å; F485-I600 HydrophobicContact CD1-CB 4.34Å; F485-I600 HydrophobicContact CD1-CG2 4.17Å; F485-I600 HydrophobicContact CD2-CD1 3.9Å; F485-I600 HydrophobicContact CE1-CB 3.8Å; F485-I600 HydrophobicContact CE1-CG2 3.96Å; F485-I600 HydrophobicContact CE2-CB 4.07Å; F485-I600 HydrophobicContact CE2-CD1 4.03Å; F485-I600 HydrophobicContact CE2-CG1 4.33Å; F485-I600 HydrophobicContact CG-CD1 4.26Å; F485-I600 HydrophobicContact CZ-CB 3.66Å; F485-I600 HydrophobicContact CZ-CD1 4.46Å; F485-I600 HydrophobicContact CZ-CG1 4.41Å; F485-I600 HydrophobicContact CZ-CG2 4.34Å; F485-I600 WeakPolarHBondContact CZ-O 3.21Å; I600-F604 HydrophobicContact CG2-CB 3.88Å; I600-F604 HydrophobicContact CG2-CD1 4.42Å; I600-F604 HydrophobicContact CG2-CD2 3.9Å; I600-F604 HydrophobicContact CG2-CG 3.83Å
601	P	92.3	Very high	84.5	Confident	39 Å²	39	73.4 Å²	73.4	25%	0.253	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-56.6	144.9	-179	-27.4	35.9	0	0	0	113.7	Y473 E603 F604	Y473-P601 HydrophobicContact CD1-CG 4.14Å; Y473-P601 HydrophobicContact CE1-CG 3.46Å; Y473-P601 VanDerWaalsContact CE1-CG 3.46Å; Y473-P601 HydrophobicContact CE2-CG 4.24Å; Y473-P601 VanDerWaalsContact CZ-CD 3.49Å; P601-E603 WeakPolarHBondContact CB-OE2 3.4Å; P601-E603 PolarHBondContact O-N 2.86Å; P601-E603 VanDerWaalsContact O-N 3.15Å; P601-F604 HydrophobicContact CB-CD2 4.3Å; P601-F604 WeakPolarHBondContact O-CB 3.25Å; P601-F604 PolarHBondContact O-N 2.88Å; P601-F604 VanDerWaalsContact O-N 3.13Å
602	E	88.8	Confident	83.9	Confident	120 Å²	120	69.6 Å²	69.6	56%	0.561	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-61.5	-25.7	-170.9	-70	-67.6	122.3	0	0	113.5	F604 K605	E602-F604 PolarHBondContact O-N 2.87Å; E602-K605 VanDerWaalsContact O-CB 3.32Å; E602-K605 WeakPolarHBondContact O-CB 3.39Å; E602-K605 PolarHBondContact O-N 3.21Å; E602-K605 WeakPolarHBondContact OE1-CE 3.4Å; E602-K605 IonicContact OE1-NZ 2.78Å; E602-K605 PolarHBondContact OE1-NZ 3.16Å; E602-K605 WeakPolarHBondContact OE2-CD 3.38Å; E602-K605 VanDerWaalsContact OE2-CE 3.23Å; E602-K605 WeakPolarHBondContact OE2-CE 3.26Å; E602-K605 IonicContact OE2-NZ 3.44Å; E602-K605 PolarHBondContact OE2-NZ 3.24Å
603	E	86.4	Confident	83.2	Confident	102 Å²	102	70.8 Å²	70.8	48%	0.477	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-59.8	-33.4	178.3	-54.9	75.9	-168.7	0	0	111.4	P601 K605 T606 Y609	P601-E603 WeakPolarHBondContact CB-OE2 3.4Å; P601-E603 PolarHBondContact O-N 2.86Å; P601-E603 VanDerWaalsContact O-N 3.15Å; E603-K605 PolarHBondContact O-N 3.29Å; E603-K605 VanDerWaalsContact O-N 3.12Å; E603-T606 PolarHBondContact O-N 2.82Å; E603-T606 PolarHBondContact O-OG1 2.99Å; E603-Y609 HydrophobicContact CB-CD2 3.62Å; E603-Y609 HydrophobicContact CB-CE2 3.46Å; E603-Y609 VanDerWaalsContact CB-CE2 3.46Å; E603-Y609 HydrophobicContact CG-CE2 4.31Å
604	F	87.4	Confident	82.4	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-63.9	-11.9	173.9	-77.8	-96.6	0	0	0	113.3	K466 L469 M470 Y473 F485 F554 I600 P601 E602 T606 Y609	K466-F604 WeakPolarHBondContact CE-O 3.25Å; K466-F604 HydrophobicContact CG-CD1 4.31Å; K466-F604 PolarHBondContact NZ-O 3.36Å; L469-F604 HydrophobicContact CB-CE1 3.91Å; L469-F604 HydrophobicContact CB-CZ 4.17Å; M470-F604 HydrophobicContact CG-CD1 3.61Å; M470-F604 HydrophobicContact CG-CE1 3.93Å; M470-F604 HydrophobicContact CG-CG 4.41Å; Y473-F604 HydrophobicContact CD2-CE2 4.35Å; Y473-F604 HydrophobicContact CD2-CZ 4.44Å; Y473-F604 AromaticContact CE2-CE2 3.62Å; Y473-F604 HydrophobicContact CE2-CE2 3.62Å; Y473-F604 AromaticContact CE2-CZ 3.84Å; Y473-F604 HydrophobicContact CE2-CZ 3.84Å; F485-F604 HydrophobicContact CD1-CB 3.68Å; F485-F604 HydrophobicContact CE1-CB 4.12Å; F554-F604 HydrophobicContact CD2-CZ 4.49Å; F554-F604 HydrophobicContact CE2-CE2 4.03Å; F554-F604 AromaticContact CE2-CZ 3.69Å; F554-F604 HydrophobicContact CE2-CZ 3.69Å; F554-F604 HydrophobicContact CZ-CE2 4.36Å; F554-F604 HydrophobicContact CZ-CZ 4.01Å; I600-F604 HydrophobicContact CG2-CB 3.88Å; I600-F604 HydrophobicContact CG2-CD1 4.42Å; I600-F604 HydrophobicContact CG2-CD2 3.9Å; I600-F604 HydrophobicContact CG2-CG 3.83Å; P601-F604 HydrophobicContact CB-CD2 4.3Å; P601-F604 WeakPolarHBondContact O-CB 3.25Å; P601-F604 PolarHBondContact O-N 2.88Å; P601-F604 VanDerWaalsContact O-N 3.13Å; E602-F604 PolarHBondContact O-N 2.87Å; F604-T606 VanDerWaalsContact C-N 3.29Å; F604-Y609 HydrophobicContact CD1-CD1 4.05Å; F604-Y609 HydrophobicContact CD1-CE1 4.27Å; F604-Y609 HydrophobicContact CD2-CD1 4.37Å; F604-Y609 HydrophobicContact CD2-CE1 4.04Å; F604-Y609 HydrophobicContact CE1-CD1 4.06Å; F604-Y609 AromaticContact CE1-CE1 3.95Å; F604-Y609 HydrophobicContact CE1-CE1 3.95Å; F604-Y609 HydrophobicContact CE2-CD1 4.37Å; F604-Y609 AromaticContact CE2-CE1 3.69Å; F604-Y609 HydrophobicContact CE2-CE1 3.69Å; F604-Y609 HydrophobicContact CG-CD1 4.21Å; F604-Y609 HydrophobicContact CG-CE1 4.32Å; F604-Y609 HydrophobicContact CZ-CD1 4.23Å; F604-Y609 AromaticContact CZ-CE1 3.64Å; F604-Y609 HydrophobicContact CZ-CE1 3.64Å
605	K	85.3	Confident	81.7	Confident	65 Å²	65	75.8 Å²	75.8	28%	0.283	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-75.7	-20.7	172.1	-60.7	-176.4	-171	169.1	0	112.2	T484 F485 P487 E602 E603	T484-K605 HydrophobicContact CG2-CD 3.97Å; T484-K605 HydrophobicContact CG2-CG 4.47Å; F485-K605 HydrophobicContact CD1-CB 4.48Å; F485-K605 HydrophobicContact CD1-CG 3.5Å; F485-K605 VanDerWaalsContact CD1-CG 3.5Å; F485-K605 HydrophobicContact CE1-CD 4.18Å; F485-K605 HydrophobicContact CE1-CG 3.42Å; F485-K605 VanDerWaalsContact CE1-CG 3.42Å; F485-K605 HydrophobicContact CG-CG 4.3Å; F485-K605 HydrophobicContact CZ-CD 4.49Å; F485-K605 VanDerWaalsContact CZ-CE 3.48Å; F485-K605 HydrophobicContact CZ-CG 4.15Å; P487-K605 WeakPolarHBondContact CG-O 3.49Å; E602-K605 VanDerWaalsContact O-CB 3.32Å; E602-K605 WeakPolarHBondContact O-CB 3.39Å; E602-K605 PolarHBondContact O-N 3.21Å; E602-K605 WeakPolarHBondContact OE1-CE 3.4Å; E602-K605 IonicContact OE1-NZ 2.78Å; E602-K605 PolarHBondContact OE1-NZ 3.16Å; E602-K605 WeakPolarHBondContact OE2-CD 3.38Å; E602-K605 VanDerWaalsContact OE2-CE 3.23Å; E602-K605 WeakPolarHBondContact OE2-CE 3.26Å; E602-K605 IonicContact OE2-NZ 3.44Å; E602-K605 PolarHBondContact OE2-NZ 3.24Å; E603-K605 PolarHBondContact O-N 3.29Å; E603-K605 VanDerWaalsContact O-N 3.12Å
606	T	79.6	Confident	80.7	Confident	63 Å²	63	68.9 Å²	68.9	39%	0.387	37%	0.367	S	S	.	.	S	Bend	trans	-73.6	142.7	176.7	69.7	0	0	0	0	111.6	K466 E603 F604 S608 Y609	K466-T606 PolarHBondContact NZ-O 3.36Å; E603-T606 PolarHBondContact O-N 2.82Å; E603-T606 PolarHBondContact O-OG1 2.99Å; F604-T606 VanDerWaalsContact C-N 3.29Å; T606-S608 PolarHBondContact O-N 2.79Å; T606-Y609 PolarHBondContact OG1-N 3.13Å
607	S	61.9	Low	79.7	Confident	77 Å²	77	71.4 Å²	71.4	54%	0.538	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-16.8	173	-63.1	0	0	0	0	113.2	D488	D488-S607 WeakPolarHBondContact OD2-CB 3.26Å; D488-S607 PolarHBondContact OD2-OG 3.49Å
608	S	57.4	Low	78.7	Confident	103 Å²	103	74.2 Å²	74.2	72%	0.72	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	10.2	-178.3	54.6	0	0	0	0	114	T606 L610	T606-S608 PolarHBondContact O-N 2.79Å; S608-L610 PolarHBondContact O-N 2.83Å
609	Y	58.4	Low	77.8	Confident	67 Å²	67	78.3 Å²	78.3	26%	0.263	41%	0.414	S	S	.	.			trans	-78.9	90.9	174.4	-157.9	-99.4	0	0	0	110.1	F554 E603 F604 T606	F554-Y609 HydrophobicContact CD2-CE1 4.38Å; F554-Y609 HydrophobicContact CE2-CE1 4.28Å; E603-Y609 HydrophobicContact CB-CD2 3.62Å; E603-Y609 HydrophobicContact CB-CE2 3.46Å; E603-Y609 VanDerWaalsContact CB-CE2 3.46Å; E603-Y609 HydrophobicContact CG-CE2 4.31Å; F604-Y609 HydrophobicContact CD1-CD1 4.05Å; F604-Y609 HydrophobicContact CD1-CE1 4.27Å; F604-Y609 HydrophobicContact CD2-CD1 4.37Å; F604-Y609 HydrophobicContact CD2-CE1 4.04Å; F604-Y609 HydrophobicContact CE1-CD1 4.06Å; F604-Y609 AromaticContact CE1-CE1 3.95Å; F604-Y609 HydrophobicContact CE1-CE1 3.95Å; F604-Y609 HydrophobicContact CE2-CD1 4.37Å; F604-Y609 AromaticContact CE2-CE1 3.69Å; F604-Y609 HydrophobicContact CE2-CE1 3.69Å; F604-Y609 HydrophobicContact CG-CD1 4.21Å; F604-Y609 HydrophobicContact CG-CE1 4.32Å; F604-Y609 HydrophobicContact CZ-CD1 4.23Å; F604-Y609 AromaticContact CZ-CE1 3.64Å; F604-Y609 HydrophobicContact CZ-CE1 3.64Å; T606-Y609 PolarHBondContact OG1-N 3.13Å
610	L	52.9	Low	76.6	Confident	107 Å²	107	68.5 Å²	68.5	56%	0.56	37%	0.373	S	S	*	.			trans	86.1	0	175.9	-56.5	148.4	0	0	0	118	K465 L469 S608	K465-L610 HydrophobicContact CD-CB 4.25Å; L469-L610 HydrophobicContact CD1-CD1 3.21Å; S608-L610 PolarHBondContact O-N 2.83Å

Retrieved 610 of 610 residues in 698.1 ms (Link to these results)

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