A0A5K4F9S8_SCHMA Loading...

Zinc finger protein

AlphaFold DB , UniProt , Accession A0A5K4F9S8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 530 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	33.8	Very low	228 Å²	228	139.9 Å²	139.9	100%	1.123	74%	0.739	S	S	*	*				0	58.8	0	-60.9	176.9	179	0	0	107.5
2	N	32.9	Very low	33.5	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	73%	0.733	S	S	*	*				66.9	88.4	88	-62.6	34.9	0	0	0	108.7
3	N	29.1	Very low	33	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	73%	0.734	S	S	*	*				59.3	104.6	50.7	-144.7	36.2	0	0	0	111.9
4	N	36.9	Very low	32.8	Very low	136 Å²	136	137.1 Å²	137.1	73%	0.727	74%	0.74	S	S	*	*			trans	-175.7	116.5	159.2	-97.4	-13	0	0	0	106.3
5	N	37.7	Very low	32.2	Very low	119 Å²	119	138.2 Å²	138.2	64%	0.636	75%	0.745	S	S	*	*				76.1	137.6	88.7	-71.4	-4.2	0	0	0	112
6	N	36.9	Very low	31.9	Very low	118 Å²	118	136.8 Å²	136.8	63%	0.631	75%	0.746	S	S	*	*			cis	-168.6	169.5	-3.6	-120.5	-22.3	0	0	0	109.2
7	N	36.9	Very low	31.3	Very low	131 Å²	131	137.9 Å²	137.9	70%	0.701	75%	0.75	S	S	*	*			trans	67	158.3	151.3	-69.5	-24.4	0	0	0	118.8
8	N	31.6	Very low	31	Very low	121 Å²	121	138 Å²	138	65%	0.647	75%	0.75	S	S	*	*			cis	-177.7	165.3	-40.7	-123.2	-37.4	0	0	0	106.4
9	N	34.3	Very low	30.6	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	75%	0.749	S	S	*	*			trans	68.2	146.9	164.8	-60.3	-34.4	0	0	0	116.9
10	N	29.5	Very low	30.3	Very low	124 Å²	124	144.8 Å²	144.8	66%	0.663	76%	0.755	S	S	*	*			cis	167.4	166.4	-25.8	-111.9	-33.4	0	0	0	105
11	N	31.8	Very low	29.9	Very low	126 Å²	126	148 Å²	148	67%	0.674	76%	0.758	S	S	*	*			trans	82.1	101.7	154.4	-63.8	-15.9	0	0	0	120.6
12	N	29.5	Very low	29.5	Very low	123 Å²	123	145.9 Å²	145.9	66%	0.658	75%	0.745	S	S	*	*				88.1	121.7	110.5	-61.5	-14.8	0	0	0	121.1
13	N	26.9	Very low	29.1	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	74%	0.74	S	S	*	*			trans	56	116.4	131.1	-57.2	-13.1	0	0	0	119.4
14	S	29.8	Very low	28.8	Very low	116 Å²	116	144.9 Å²	144.9	81%	0.811	74%	0.744	S	S	*	*				160.2	126.8	101.8	-68.1	0	0	0	0	111.1
15	N	24.3	Very low	28.1	Very low	154 Å²	154	148.1 Å²	148.1	82%	0.824	75%	0.752	S	S	*	*			trans	-80.2	153.5	164.3	-141.4	2.8	0	0	0	108.8
16	P	27.6	Very low	27.6	Very low	116 Å²	116	147 Å²	147	75%	0.753	76%	0.759	S	S	*	*			trans	-138.9	128.4	135.3	33.2	-19.1	0	0	0	114.6
17	L	22.2	Very low	26.9	Very low	155 Å²	155	150.3 Å²	150.3	81%	0.812	77%	0.77	S	S	*	*			trans	-70.6	126.5	144.6	-80.4	154.3	0	0	0	108.2
18	N	25.6	Very low	26.3	Very low	140 Å²	140	154.8 Å²	154.8	75%	0.749	78%	0.777	S	S	*	*				-178.6	139.5	126.5	-98.6	-30	0	0	0	115
19	Y	22.5	Very low	25.9	Very low	188 Å²	188	156.1 Å²	156.1	74%	0.737	78%	0.779	S	S	*	*			trans	19.8	124.5	140.3	-80	-107	0	0	0	119.8
20	Y	25.7	Very low	25.3	Very low	224 Å²	224	156.1 Å²	156.1	88%	0.878	78%	0.779	S	S	*	*				-139.1	128.6	119.8	-109.5	-86.1	0	0	0	110.5
21	R	22	Very low	25	Very low	213 Å²	213	157 Å²	157	80%	0.804	78%	0.783	S	S	*	*			trans	-80.1	138.6	159.4	-81.7	175.2	167.7	167.4	-5.4	106.7
22	E	26.6	Very low	24.5	Very low	183 Å²	183	157 Å²	157	86%	0.855	79%	0.791	S	S	*	*			trans	-150.1	134.4	142.9	-121.6	161.3	-135.7	0	0	111.1
23	T	23	Very low	24.2	Very low	113 Å²	113	159.4 Å²	159.4	69%	0.693	80%	0.796	S	S	*	*			trans	-90.6	130.6	-172.7	44.3	0	0	0	0	110.5
24	N	24.7	Very low	24.1	Very low	165 Å²	165	160.1 Å²	160.1	88%	0.882	80%	0.8	S	S	*	*			trans	-126.7	97.2	159.2	-95.9	-47.4	0	0	0	110.2
25	F	21.8	Very low	23.7	Very low	205 Å²	205	161.6 Å²	161.6	90%	0.899	80%	0.799	S	S	*	*			trans	-73.3	117.9	166.6	-100.8	-100.9	0	0	0	109
26	A	25.9	Very low	23.8	Very low	94 Å²	94	161.6 Å²	161.6	78%	0.777	80%	0.798	S	S	*	*			trans	-148.4	113.9	163.1	0	0	0	0	0	110.4	R28	A26-R28 PolarHBondContact O-N 3.4Å
27	H	22.7	Very low	23.5	Very low	189 Å²	189	163.1 Å²	163.1	88%	0.875	80%	0.8	S	S	*	*			trans	-32.6	126.4	175	-97.6	-91	0	0	0	115.7
28	R	24.2	Very low	23.5	Very low	224 Å²	224	162.4 Å²	162.4	85%	0.845	80%	0.797	S	S	*	*			trans	-170.9	101.5	131.3	-103.4	164.4	-155.4	-92.4	4.8	112.2	A26	A26-R28 PolarHBondContact O-N 3.4Å
29	Q	23	Very low	23.4	Very low	149 Å²	149	163.1 Å²	163.1	70%	0.696	80%	0.8	S	S	*	*			trans	44.3	108.5	134.3	-78	166.4	-24.3	0	0	119.6
30	D	22.1	Very low	23.4	Very low	136 Å²	136	158.7 Å²	158.7	73%	0.727	80%	0.797	S	S	*	*				97.9	114.9	122.7	-55.5	-17.8	0	0	0	120.8
31	I	22.8	Very low	23.4	Very low	143 Å²	143	159.6 Å²	159.6	73%	0.733	80%	0.799	S	S	*	*			trans	84.1	95.2	155.6	-55.4	162.1	0	0	0	116.8	F33	I31-F33 HydrophobicContact CG2-CD2 3.49Å; I31-F33 VanDerWaalsContact CG2-CD2 3.49Å; I31-F33 HydrophobicContact CG2-CE2 3.96Å
32	C	21.1	Very low	23.4	Very low	126 Å²	126	158.9 Å²	158.9	85%	0.851	80%	0.802	S	S	*	*			trans	-66.6	138.2	152.7	-60.5	0	0	0	0	110.4
33	F	24.1	Very low	23.3	Very low	174 Å²	174	159.9 Å²	159.9	76%	0.763	80%	0.798	S	S	*	*			trans	-143.5	74.7	159.9	-105.8	-68.8	0	0	0	110.1	I31	I31-F33 HydrophobicContact CG2-CD2 3.49Å; I31-F33 VanDerWaalsContact CG2-CD2 3.49Å; I31-F33 HydrophobicContact CG2-CE2 3.96Å
34	N	23.8	Very low	23.3	Very low	155 Å²	155	159.8 Å²	159.8	83%	0.829	79%	0.793	S	S	*	*	S	Bend	trans	-149.7	72.6	162	-98.6	-18.7	0	0	0	106.3
35	D	22.8	Very low	23.3	Very low	147 Å²	147	160.4 Å²	160.4	79%	0.786	80%	0.795	S	S	*	*			trans	-175.4	174.3	161	-95.3	-30.7	0	0	0	108.9
36	L	25.4	Very low	23.4	Very low	154 Å²	154	156.4 Å²	156.4	81%	0.806	78%	0.783	S	S	*	*			trans	70.5	95.9	-166.2	-46.1	-179.9	0	0	0	111.4
37	N	22.7	Very low	23.3	Very low	148 Å²	148	158.3 Å²	158.3	79%	0.791	78%	0.78	S	S	*	*			cis	55.8	131.6	35.5	-122.5	15	0	0	0	112.2	N39	N37-N39 PolarHBondContact O-N 3.19Å
38	N	22.2	Very low	23.4	Very low	141 Å²	141	158.3 Å²	158.3	75%	0.754	78%	0.783	S	S	*	*	S	Bend	trans	-20.5	118.3	177.4	-59.1	-19.5	0	0	0	115.7
39	N	22.4	Very low	23.4	Very low	154 Å²	154	152.2 Å²	152.2	82%	0.824	78%	0.775	S	S	*	*				171.9	138.7	113.4	-85.4	-25.7	0	0	0	114.7	N37	N37-N39 PolarHBondContact O-N 3.19Å
40	S	23.4	Very low	23.5	Very low	96 Å²	96	148.4 Å²	148.4	67%	0.671	76%	0.764	S	S	*	*			trans	51.2	91.2	138.6	-175.1	0	0	0	0	119.9
41	W	24.5	Very low	23.5	Very low	242 Å²	242	149.1 Å²	149.1	92%	0.917	77%	0.768	S	S	*	*				-126.4	103.1	123.5	-77.9	76.6	0	0	0	108.7	W43	W41-W43 PolarHBondContact O-N 3.08Å
42	K	22.4	Very low	23.6	Very low	198 Å²	198	148.1 Å²	148.1	86%	0.861	76%	0.763	S	S	*	*			trans	-85.5	97.1	178.9	178.5	-171.3	-179	-174.9	0	108.5
43	W	24	Very low	23.7	Very low	205 Å²	205	151.4 Å²	151.4	78%	0.777	76%	0.764	S	S	*	*			trans	-133	121.9	162.7	-82.1	94.4	0	0	0	109.9	W41	W41-W43 PolarHBondContact O-N 3.08Å
44	D	24	Very low	23.7	Very low	110 Å²	110	154.1 Å²	154.1	59%	0.588	77%	0.769	S	S	*	*			trans	62.6	69	157.6	-51.1	-22.1	0	0	0	119.7	L46	D44-L46 PolarHBondContact O-N 2.96Å
45	L	24.2	Very low	23.7	Very low	178 Å²	178	153.8 Å²	153.8	93%	0.932	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	33.9	152.4	-122.6	173.1	0	0	0	112.4
46	L	23.5	Very low	23.9	Very low	121 Å²	121	155.8 Å²	155.8	63%	0.634	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.6	7.5	-163.1	-97.4	173.4	0	0	0	116.9	D44	D44-L46 PolarHBondContact O-N 2.96Å
47	N	23.9	Very low	24	Very low	135 Å²	135	153.3 Å²	153.3	72%	0.722	78%	0.779	S	S	*	*	S	Bend	trans	-135.7	133.2	171.2	-97.1	-41	0	0	0	114.3	S50	N47-S50 WeakPolarHBondContact CA-OG 3.47Å; N47-S50 PolarHBondContact OD1-OG 2.97Å
48	M	24.4	Very low	24.1	Very low	188 Å²	188	153.9 Å²	153.9	93%	0.926	78%	0.78	S	S	*	*	S	Bend	trans	85.4	7.3	-179.3	-48.7	-153.5	78.7	0	0	118.5	S50	M48-S50 VanDerWaalsContact C-N 3.29Å; M48-S50 PolarHBondContact N-OG 3.34Å
49	S	24.7	Very low	24.4	Very low	97 Å²	97	156 Å²	156	68%	0.678	78%	0.782	S	S	*	*	S	Bend	trans	-97.3	18.8	140.4	66.4	0	0	0	0	111.5	N51	S49-N51 PolarHBondContact O-N 3.18Å
50	S	24.7	Very low	24.6	Very low	68 Å²	68	153.1 Å²	153.1	48%	0.476	78%	0.775	S	S	.	*			trans	-77.5	31.8	-171.4	-36.6	0	0	0	0	114.3	N47 M48	N47-S50 WeakPolarHBondContact CA-OG 3.47Å; N47-S50 PolarHBondContact OD1-OG 2.97Å; M48-S50 VanDerWaalsContact C-N 3.29Å; M48-S50 PolarHBondContact N-OG 3.34Å
51	N	22.9	Very low	24.6	Very low	151 Å²	151	155.2 Å²	155.2	81%	0.807	78%	0.783	S	S	*	*	S	Bend	trans	-139.4	118.2	169.8	-87.9	-36.7	0	0	0	108	S49	S49-N51 PolarHBondContact O-N 3.18Å
52	L	24.5	Very low	24.7	Very low	122 Å²	122	149.3 Å²	149.3	64%	0.639	78%	0.779	S	S	*	*	S	Bend	trans	85.9	130.3	-177.5	-52.3	161.6	0	0	0	115.7	F82	L52-F82 HydrophobicContact CD2-CE1 4.22Å; L52-F82 HydrophobicContact CD2-CZ 3.86Å
53	F	24.2	Very low	24.9	Very low	196 Å²	196	148.4 Å²	148.4	86%	0.86	78%	0.778	S	S	*	*			trans	73.2	79.8	171.9	-56.8	-76.2	0	0	0	119.1
54	R	22.6	Very low	24.9	Very low	231 Å²	231	143.4 Å²	143.4	87%	0.872	77%	0.774	S	S	*	*			trans	-149	74.4	144.7	-161.2	176.2	-173.2	167.1	2.2	113.5
55	V	23.8	Very low	24.9	Very low	147 Å²	147	143.1 Å²	143.1	89%	0.891	78%	0.781	S	S	*	*			trans	-139	88.5	153.9	-175.3	0	0	0	0	107.3
56	E	27.4	Very low	25	Very low	189 Å²	189	139.4 Å²	139.4	88%	0.883	77%	0.77	S	S	*	*			trans	-108.4	147.1	163.2	-83.5	-170.4	150.4	0	0	109.4
57	A	28.2	Very low	25.1	Very low	103 Å²	103	141.4 Å²	141.4	85%	0.851	78%	0.778	S	S	*	*			trans	-76.1	137	-152.4	0	0	0	0	0	114.7
58	I	24.5	Very low	25.2	Very low	160 Å²	160	141.2 Å²	141.2	82%	0.821	78%	0.777	S	S	*	*			trans	-91.6	116.6	158	-49.7	176.1	0	0	0	107.5
59	K	28.7	Very low	25.2	Very low	185 Å²	185	137 Å²	137	80%	0.804	77%	0.765	S	S	*	*			trans	158.4	98.8	134.8	-86.4	175.8	-176	-179.2	0	112.5
60	S	26.2	Very low	25.2	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	77%	0.768	S	S	*	*				14.1	115.9	127.8	55.3	0	0	0	0	119
61	T	22.7	Very low	25.4	Very low	139 Å²	139	141.4 Å²	141.4	85%	0.853	78%	0.782	S	S	*	*			trans	31.3	103.1	130.1	56.4	0	0	0	0	119.2
62	S	26.8	Very low	25.8	Very low	119 Å²	119	141 Å²	141	83%	0.832	78%	0.779	S	S	*	*			trans	-161.2	144.3	142.5	53.4	0	0	0	0	111.4
63	Q	27	Very low	25.9	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	79%	0.786	S	S	*	*			trans	-66.9	158.6	-166	-62.4	142.5	-37.4	0	0	115.7
64	S	24.5	Very low	26.3	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	77%	0.772	S	S	*	*			trans	54.5	125.2	140.3	61.3	0	0	0	0	122
65	S	24.2	Very low	26.4	Very low	104 Å²	104	132 Å²	132	73%	0.727	77%	0.768	S	S	*	*			trans	72.2	134.3	135.8	56.8	0	0	0	0	122.1
66	S	25.7	Very low	26.5	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	77%	0.769	S	S	*	*			trans	69.3	113.1	143.8	60.9	0	0	0	0	121
67	M	26.3	Very low	26.5	Very low	163 Å²	163	134.7 Å²	134.7	80%	0.803	77%	0.767	S	S	*	*				78.5	124.9	124.8	-75.5	-178.6	160.4	0	0	121.1
68	N	25.4	Very low	26.4	Very low	131 Å²	131	134.8 Å²	134.8	70%	0.701	76%	0.759	S	S	*	*			trans	81.6	99.8	131.3	-64.8	1.6	0	0	0	120
69	S	24.3	Very low	26.4	Very low	98 Å²	98	133.5 Å²	133.5	69%	0.685	76%	0.758	S	S	*	*				75.2	111.3	115.5	70.6	0	0	0	0	120.6
70	S	24.8	Very low	26.3	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	76%	0.757	S	S	*	*				104	147.3	119.5	81.4	0	0	0	0	119.8
71	M	29.6	Very low	26.5	Very low	155 Å²	155	134.4 Å²	134.4	76%	0.764	76%	0.76	S	S	*	*			trans	84.5	104.9	157	-63.9	-166.6	173.1	0	0	120.3
72	N	30.2	Very low	26.8	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	75%	0.748	S	S	*	*				71.2	141.1	117.8	-56.1	-4.3	0	0	0	118.8
73	D	27.8	Very low	27	Very low	145 Å²	145	137 Å²	137	78%	0.775	75%	0.747	S	S	*	*			cis	-161.1	-161.8	-15.5	-160	19.5	0	0	0	107.4
74	P	31.7	Very low	27.2	Very low	86 Å²	86	133.6 Å²	133.6	56%	0.558	74%	0.735	S	S	*	*				-116.6	175	-113.6	36.9	-19	0	0	0	115.3
75	T	24.7	Very low	27.4	Very low	129 Å²	129	131.3 Å²	131.3	79%	0.791	72%	0.722	S	S	*	*				154.5	93	126.5	43.6	0	0	0	0	113
76	L	26.3	Very low	27.8	Very low	173 Å²	173	131.8 Å²	131.8	91%	0.906	72%	0.716	S	S	*	*			trans	-169.3	149.9	147.7	-105.3	145.9	0	0	0	110.6
77	Y	26.7	Very low	28.2	Very low	219 Å²	219	130.1 Å²	130.1	86%	0.859	70%	0.702	S	S	*	*			trans	-75.4	161.5	-155.3	-79.7	-101.3	0	0	0	116.2
78	P	26.6	Very low	28.5	Very low	105 Å²	105	126.1 Å²	126.1	68%	0.682	68%	0.684	S	S	*	*			trans	-80.4	144.5	-160.1	-11.6	28.2	0	0	0	115.7
79	V	25.4	Very low	29	Very low	132 Å²	132	124.3 Å²	124.3	80%	0.8	67%	0.673	S	S	*	*			trans	-100	82.9	169.7	-177.8	0	0	0	0	109.8
80	E	26.3	Very low	29.5	Very low	165 Å²	165	124.7 Å²	124.7	77%	0.771	66%	0.664	S	S	*	*			trans	-104.3	112	167.4	-68.4	-174.6	175	0	0	109.4
81	N	29.7	Very low	30.3	Very low	134 Å²	134	126.2 Å²	126.2	72%	0.717	66%	0.657	S	S	*	*	S	Bend	trans	170	-13.3	151.3	-96.6	-54.6	0	0	0	114.9	E83	N81-E83 PolarHBondContact O-N 3.43Å
82	F	28.8	Very low	30.6	Very low	139 Å²	139	124.1 Å²	124.1	61%	0.61	65%	0.648	S	S	*	*	H	α-helix	trans	-74	-27	-169.2	-94.9	-89.1	0	0	0	116	L52	L52-F82 HydrophobicContact CD2-CE1 4.22Å; L52-F82 HydrophobicContact CD2-CZ 3.86Å
83	E	30.6	Very low	30.8	Very low	173 Å²	173	121.1 Å²	121.1	81%	0.808	63%	0.631	S	S	*	*	H	α-helix	trans	-76.4	-24.7	-178.4	-63.6	-169.3	135	0	0	113.9	N81 A85 T87	N81-E83 PolarHBondContact O-N 3.43Å; E83-A85 VanDerWaalsContact C-N 3.33Å; E83-A85 PolarHBondContact O-N 2.97Å; E83-T87 PolarHBondContact O-N 3.18Å; E83-T87 PolarHBondContact O-OG1 3.3Å; E83-T87 VanDerWaalsContact O-OG1 3.13Å
84	N	31.2	Very low	31.2	Very low	108 Å²	108	121 Å²	121	58%	0.578	62%	0.624	S	S	*	*	H	α-helix	trans	-72.1	-23.7	176.6	-100.7	-27.8	0	0	0	113.1	T87 N88	N84-T87 PolarHBondContact O-OG1 2.95Å; N84-N88 WeakPolarHBondContact O-CB 3.4Å; N84-N88 PolarHBondContact O-N 3.21Å; N84-N88 PolarHBondContact O-ND2 3.16Å
85	A	30	Very low	31.3	Very low	52 Å²	52	119.5 Å²	119.5	43%	0.43	62%	0.619	S	S	.	*	H	α-helix	trans	-70.6	-44.8	177.3	0	0	0	0	0	111.7	E83 N88 I89	E83-A85 VanDerWaalsContact C-N 3.33Å; E83-A85 PolarHBondContact O-N 2.97Å; A85-N88 PolarHBondContact O-N 3.26Å; A85-I89 WeakPolarHBondContact O-CG1 3.33Å; A85-I89 PolarHBondContact O-N 3.32Å
86	N	31.2	Very low	31.7	Very low	113 Å²	113	120.7 Å²	120.7	60%	0.604	61%	0.613	S	S	*	*	H	α-helix	trans	-72.2	-38.5	-174.7	-119.4	-6.6	0	0	0	112.6	N88 I89 Q90	N86-N88 VanDerWaalsContact C-N 3.32Å; N86-N88 PolarHBondContact O-N 2.97Å; N86-I89 PolarHBondContact O-N 2.9Å; N86-Q90 WeakPolarHBondContact O-CG 3.38Å; N86-Q90 PolarHBondContact O-N 3.39Å
87	T	35.5	Very low	31.9	Very low	66 Å²	66	117.3 Å²	117.3	41%	0.405	60%	0.596	S	S	.	*	H	α-helix	trans	-66	-33.3	174.1	47.3	0	0	0	0	112.5	E83 N84 K91	E83-T87 PolarHBondContact O-N 3.18Å; E83-T87 PolarHBondContact O-OG1 3.3Å; E83-T87 VanDerWaalsContact O-OG1 3.13Å; N84-T87 PolarHBondContact O-OG1 2.95Å; T87-K91 WeakPolarHBondContact O-CD 3.36Å; T87-K91 VanDerWaalsContact O-CG 3.24Å; T87-K91 WeakPolarHBondContact O-CG 3.44Å; T87-K91 PolarHBondContact O-N 3.2Å
88	N	32.6	Very low	32.4	Very low	79 Å²	79	112 Å²	112	42%	0.422	58%	0.582	S	S	.	*	H	α-helix	trans	-72.1	-38.8	174.1	-76.9	-35.6	0	0	0	112.8	N84 A85 N86 K91 I92	N84-N88 WeakPolarHBondContact O-CB 3.4Å; N84-N88 PolarHBondContact O-N 3.21Å; N84-N88 PolarHBondContact O-ND2 3.16Å; A85-N88 PolarHBondContact O-N 3.26Å; N86-N88 VanDerWaalsContact C-N 3.32Å; N86-N88 PolarHBondContact O-N 2.97Å; N88-K91 PolarHBondContact O-N 3.5Å; N88-I92 WeakPolarHBondContact O-CD1 3.48Å; N88-I92 VanDerWaalsContact O-CG1 3.26Å; N88-I92 WeakPolarHBondContact O-CG1 3.22Å; N88-I92 PolarHBondContact O-N 2.79Å
89	I	34.7	Very low	32.6	Very low	92 Å²	92	112.9 Å²	112.9	47%	0.472	58%	0.576	S	S	.	*	H	α-helix	trans	-62.5	-43.5	173.7	-68.3	166	0	0	0	111	A85 N86 K91 I92 I93	A85-I89 WeakPolarHBondContact O-CG1 3.33Å; A85-I89 PolarHBondContact O-N 3.32Å; N86-I89 PolarHBondContact O-N 2.9Å; I89-K91 VanDerWaalsContact C-N 3.35Å; I89-K91 PolarHBondContact O-N 3.38Å; I89-I92 PolarHBondContact O-N 3.14Å; I89-I93 HydrophobicContact CG2-CD1 3.95Å; I89-I93 WeakPolarHBondContact O-CG1 3.3Å; I89-I93 PolarHBondContact O-N 3.15Å
90	Q	36.2	Very low	32.9	Very low	107 Å²	107	112.5 Å²	112.5	50%	0.5	57%	0.569	S	S	.	*	H	α-helix	trans	-63.6	-35.7	175.5	-73.6	-70.8	-20.2	0	0	113.2	N86 K94	N86-Q90 WeakPolarHBondContact O-CG 3.38Å; N86-Q90 PolarHBondContact O-N 3.39Å; Q90-K94 WeakPolarHBondContact O-CG 3.44Å; Q90-K94 PolarHBondContact O-N 3.41Å; Q90-K94 VanDerWaalsContact O-N 3.16Å
91	K	41.4	Very low	33.1	Very low	135 Å²	135	112.5 Å²	112.5	59%	0.587	57%	0.569	S	S	*	*	H	α-helix	trans	-67.1	-39.9	172.3	-73.4	166.4	-174.7	172	0	112.1	T87 N88 I89 K94 A95	T87-K91 WeakPolarHBondContact O-CD 3.36Å; T87-K91 VanDerWaalsContact O-CG 3.24Å; T87-K91 WeakPolarHBondContact O-CG 3.44Å; T87-K91 PolarHBondContact O-N 3.2Å; N88-K91 PolarHBondContact O-N 3.5Å; I89-K91 VanDerWaalsContact C-N 3.35Å; I89-K91 PolarHBondContact O-N 3.38Å; K91-K94 PolarHBondContact O-N 3.34Å; K91-A95 WeakPolarHBondContact O-CB 3.44Å; K91-A95 PolarHBondContact O-N 3.22Å
92	I	34.6	Very low	33.1	Very low	111 Å²	111	113.4 Å²	113.4	57%	0.569	57%	0.573	S	S	*	*	H	α-helix	trans	-66.4	-37.6	177.4	-69.7	162.9	0	0	0	111.6	N88 I89 K96	N88-I92 WeakPolarHBondContact O-CD1 3.48Å; N88-I92 VanDerWaalsContact O-CG1 3.26Å; N88-I92 WeakPolarHBondContact O-CG1 3.22Å; N88-I92 PolarHBondContact O-N 2.79Å; I89-I92 PolarHBondContact O-N 3.14Å; I92-K96 PolarHBondContact O-N 3.33Å
93	I	34.5	Very low	33.1	Very low	81 Å²	81	111.6 Å²	111.6	42%	0.415	58%	0.577	S	S	.	*	H	α-helix	trans	-65.6	-51.2	175.6	-67.6	165.9	0	0	0	110.2	I89 A95 K96 D97	I89-I93 HydrophobicContact CG2-CD1 3.95Å; I89-I93 WeakPolarHBondContact O-CG1 3.3Å; I89-I93 PolarHBondContact O-N 3.15Å; I93-A95 VanDerWaalsContact C-N 3.26Å; I93-A95 PolarHBondContact O-N 3.5Å; I93-K96 WeakPolarHBondContact O-CB 3.45Å; I93-K96 PolarHBondContact O-N 3.27Å; I93-D97 PolarHBondContact O-N 3.22Å
94	K	36.8	Very low	32.8	Very low	142 Å²	142	109.9 Å²	109.9	62%	0.617	57%	0.572	S	S	*	*	H	α-helix	trans	-61.7	-30.7	177.4	-69.9	-177.5	178.7	-174.8	0	113.7	Q90 K91 K96	Q90-K94 WeakPolarHBondContact O-CG 3.44Å; Q90-K94 PolarHBondContact O-N 3.41Å; Q90-K94 VanDerWaalsContact O-N 3.16Å; K91-K94 PolarHBondContact O-N 3.34Å; K94-K96 VanDerWaalsContact C-N 3.3Å
95	A	33.8	Very low	32.7	Very low	54 Å²	54	112.7 Å²	112.7	45%	0.446	58%	0.582	S	S	.	*	H	α-helix	trans	-71.9	-23.3	173.7	0	0	0	0	0	113.4	K91 I93	K91-A95 WeakPolarHBondContact O-CB 3.44Å; K91-A95 PolarHBondContact O-N 3.22Å; I93-A95 VanDerWaalsContact C-N 3.26Å; I93-A95 PolarHBondContact O-N 3.5Å
96	K	33	Very low	32.7	Very low	155 Å²	155	118.7 Å²	118.7	67%	0.674	60%	0.598	S	S	*	*	H	α-helix	trans	-83.4	-32	-178.5	-163.3	169.6	-176.1	176.2	0	112.7	I92 I93 K94	I92-K96 PolarHBondContact O-N 3.33Å; I93-K96 WeakPolarHBondContact O-CB 3.45Å; I93-K96 PolarHBondContact O-N 3.27Å; K94-K96 VanDerWaalsContact C-N 3.3Å
97	D	31.2	Very low	32.4	Very low	101 Å²	101	120.8 Å²	120.8	54%	0.54	61%	0.61	S	S	.	*	H	α-helix	trans	-71.6	-40	175.6	-62.1	-33.5	0	0	0	111.3	I93 F99 N100	I93-D97 PolarHBondContact O-N 3.22Å; D97-F99 PolarHBondContact O-N 3.09Å; D97-N100 PolarHBondContact O-N 3.29Å
98	N	37	Very low	32	Very low	109 Å²	109	122.4 Å²	122.4	58%	0.583	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-18.4	177.1	-70.8	-1.5	0	0	0	114.5
99	F	31.2	Very low	31.7	Very low	123 Å²	123	126.1 Å²	126.1	54%	0.539	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-12.6	-178.4	-116.6	-88.9	0	0	0	113.8	D97	D97-F99 PolarHBondContact O-N 3.09Å
100	N	30.6	Very low	31.3	Very low	124 Å²	124	132.1 Å²	132.1	66%	0.663	65%	0.654	S	S	*	*	S	Bend	trans	-91.6	-13.5	-179.2	-77.4	-33.4	0	0	0	114.3	D97	D97-N100 PolarHBondContact O-N 3.29Å
101	E	30.6	Very low	30.9	Very low	164 Å²	164	132.3 Å²	132.3	77%	0.766	66%	0.663	S	S	*	*	S	Bend	trans	-90.9	-10.8	-179.1	-64.2	-165.5	144.7	0	0	114.1
102	L	29.9	Very low	30.2	Very low	154 Å²	154	131.9 Å²	131.9	81%	0.806	67%	0.667	S	S	*	*	S	Bend	trans	-98.7	4.8	-169.8	-78.1	163.5	0	0	0	115.8
103	S	29.2	Very low	29.8	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	67%	0.673	S	S	*	*	S	Bend	trans	-103	10.3	-177.8	55	0	0	0	0	114.8
104	I	24.4	Very low	29.5	Very low	137 Å²	137	135.5 Å²	135.5	70%	0.703	69%	0.693	S	S	*	*			trans	-114.2	81.6	-180	-51.9	176.7	0	0	0	110.5
105	Q	29.3	Very low	29	Very low	167 Å²	167	135.1 Å²	135.1	78%	0.78	70%	0.697	S	S	*	*			trans	-172.7	124.8	156.2	-108.8	159.4	73.4	0	0	115
106	K	28.5	Very low	28.7	Very low	178 Å²	178	138.5 Å²	138.5	77%	0.774	71%	0.708	S	S	*	*			trans	65	123.9	153	-57.7	172.8	-178.4	175.7	0	117.7
107	N	25.8	Very low	28.5	Very low	157 Å²	157	137.3 Å²	137.3	84%	0.84	71%	0.709	S	S	*	*				-147.9	149.5	61.8	-101	-12	0	0	0	114.2
108	P	26.1	Very low	28.4	Very low	100 Å²	100	138.3 Å²	138.3	65%	0.649	71%	0.714	S	S	*	*			trans	-97.5	-177.2	172.6	39.8	-34.5	0	0	0	113.9
109	E	25.8	Very low	28.1	Very low	158 Å²	158	138.7 Å²	138.7	74%	0.738	72%	0.717	S	S	*	*			trans	76.9	110.3	171.2	-56.6	172	-165.3	0	0	115
110	Y	28.1	Very low	27.9	Very low	217 Å²	217	139 Å²	139	85%	0.851	72%	0.723	S	S	*	*				-159.3	89.2	78.4	-108	-94.4	0	0	0	113.4
111	V	26.3	Very low	27.8	Very low	112 Å²	112	138.8 Å²	138.8	68%	0.679	72%	0.722	S	S	*	*				22.9	135.5	128.2	173.6	0	0	0	0	121.9
112	N	26.9	Very low	27.6	Very low	125 Å²	125	137.2 Å²	137.2	67%	0.668	72%	0.719	S	S	*	*			trans	76.2	148.7	156.5	-71	-10.6	0	0	0	120.3
113	Q	25.7	Very low	27.5	Very low	150 Å²	150	137.4 Å²	137.4	70%	0.701	72%	0.721	S	S	*	*			cis	-171.4	135.6	-18.1	-113.8	169.6	28.6	0	0	108.7
114	S	29.2	Very low	27.3	Very low	118 Å²	118	141.7 Å²	141.7	83%	0.825	73%	0.73	S	S	*	*			trans	165.7	76.1	154.4	53.3	0	0	0	0	109.8
115	N	26.9	Very low	27.4	Very low	134 Å²	134	140.7 Å²	140.7	72%	0.717	73%	0.733	S	S	*	*				51.5	106.6	88.1	-84.4	-0.7	0	0	0	117
116	N	26.4	Very low	27.1	Very low	125 Å²	125	139.9 Å²	139.9	67%	0.668	73%	0.732	S	S	*	*				97.9	139.9	120.1	-72.3	-10.1	0	0	0	122
117	N	30.2	Very low	26.8	Very low	130 Å²	130	138.4 Å²	138.4	70%	0.695	73%	0.733	S	S	*	*			trans	76.9	138.5	154.5	-58.9	-18.5	0	0	0	117.8
118	N	29	Very low	26.8	Very low	122 Å²	122	138.4 Å²	138.4	65%	0.652	73%	0.732	S	S	*	*			cis	-167.6	156.8	-22.8	-118.1	-15.5	0	0	0	109.5
119	N	29	Very low	26.5	Very low	118 Å²	118	139 Å²	139	63%	0.631	73%	0.734	S	S	*	*			trans	62.1	113.2	143.8	-65	-11.9	0	0	0	121.5
120	N	27.8	Very low	26.4	Very low	128 Å²	128	139 Å²	139	68%	0.684	74%	0.735	S	S	*	*				99.7	128.7	112.9	-72.8	-3.2	0	0	0	121.8
121	N	28.7	Very low	26.1	Very low	120 Å²	120	134.5 Å²	134.5	64%	0.642	73%	0.727	S	S	*	*			trans	87.7	99.6	136.7	-66.6	-4.1	0	0	0	120.5
122	N	26.1	Very low	26.1	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	74%	0.737	S	S	*	*				90.7	137.1	116.9	-64.3	-14.3	0	0	0	120.5
123	N	28.1	Very low	25.8	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	74%	0.743	S	S	*	*			trans	89.5	115.1	153	-60.3	-14.2	0	0	0	119.7
124	Q	25.8	Very low	25.7	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	74%	0.744	S	S	*	*			trans	-47.1	173.6	171.3	-94.4	-164.3	-4.6	0	0	117.7
125	P	25.3	Very low	25.5	Very low	117 Å²	117	144.8 Å²	144.8	76%	0.76	74%	0.742	S	S	*	*			trans	-97.7	163.4	-135.1	38.6	-38.9	0	0	0	115
126	I	23.9	Very low	25.4	Very low	150 Å²	150	146.2 Å²	146.2	77%	0.769	74%	0.744	S	S	*	*			trans	-120.3	127.2	171.4	-64	177.1	0	0	0	109.7	L128	I126-L128 HydrophobicContact CG2-CD1 4.35Å; I126-L128 HydrophobicContact CG2-CG 4.11Å
127	D	21.9	Very low	25.3	Very low	147 Å²	147	147.9 Å²	147.9	79%	0.786	75%	0.748	S	S	*	*			trans	-79.1	126.1	168.6	-174.2	7.9	0	0	0	108.9
128	L	24.9	Very low	24.9	Very low	157 Å²	157	152.9 Å²	152.9	82%	0.822	76%	0.757	S	S	*	*			trans	-132.3	101.1	176.8	-92.1	168.7	0	0	0	110.7	I126	I126-L128 HydrophobicContact CG2-CD1 4.35Å; I126-L128 HydrophobicContact CG2-CG 4.11Å
129	T	21.7	Very low	24.6	Very low	111 Å²	111	155.9 Å²	155.9	68%	0.681	77%	0.767	S	S	*	*			trans	-77.7	160.9	161.9	52.2	0	0	0	0	111
130	M	21.9	Very low	24.4	Very low	158 Å²	158	159 Å²	159	78%	0.778	78%	0.777	S	S	*	*			trans	80.3	137.6	165	-86.4	-61	-163.1	0	0	120.8
131	N	22.6	Very low	24.1	Very low	124 Å²	124	160.5 Å²	160.5	66%	0.663	79%	0.785	S	S	*	*			trans	53.7	110	151.5	-64.1	-28.7	0	0	0	119.3
132	H	26.3	Very low	23.8	Very low	194 Å²	194	163.6 Å²	163.6	90%	0.898	80%	0.796	S	S	*	*				-145.7	126.4	111.6	-108.3	71	0	0	0	110.6
133	Y	21.7	Very low	23.7	Very low	202 Å²	202	165.6 Å²	165.6	79%	0.792	81%	0.806	S	S	*	*			trans	-103	152.6	171.7	-136.8	-89.7	0	0	0	107.5
134	H	23.2	Very low	23.5	Very low	156 Å²	156	160.8 Å²	160.8	72%	0.722	79%	0.785	S	S	*	*			trans	77.1	135.9	169.2	-80.8	-56.3	0	0	0	121.8
135	Q	23.4	Very low	23.5	Very low	169 Å²	169	162.8 Å²	162.8	79%	0.79	79%	0.785	S	S	*	*			trans	67.8	101.6	151.2	-67.8	173.8	8	0	0	118.5
136	H	25.1	Very low	23.5	Very low	164 Å²	164	164.7 Å²	164.7	76%	0.759	78%	0.784	S	S	*	*				-162.6	129.5	126.3	-105	-75.9	0	0	0	110
137	H	25.4	Very low	23.6	Very low	160 Å²	160	164 Å²	164	74%	0.741	78%	0.778	S	S	*	*			trans	52.9	123.5	165.8	-52.9	-65.9	0	0	0	118.1
138	R	21.3	Very low	23.7	Very low	234 Å²	234	163 Å²	163	88%	0.883	78%	0.777	S	S	*	*			cis	48.5	73.4	33.1	-79.4	-155.4	-170.4	-158.5	6.9	113.7
139	H	23.2	Very low	23.9	Very low	186 Å²	186	160.4 Å²	160.4	86%	0.861	77%	0.768	S	S	*	*			trans	-167.1	176.3	131.3	-101.7	-78.9	0	0	0	107.6
140	E	24.3	Very low	24.1	Very low	182 Å²	182	158.6 Å²	158.6	85%	0.85	76%	0.759	S	S	*	*			trans	72	50.7	175.8	-54.5	-176.8	-179.4	0	0	117.5
141	N	22.1	Very low	24.2	Very low	161 Å²	161	158.1 Å²	158.1	86%	0.861	76%	0.759	S	S	*	*			trans	-79.2	148.6	132.3	-90.7	-20.9	0	0	0	107.6
142	Q	22.7	Very low	24.4	Very low	185 Å²	185	160.7 Å²	160.7	86%	0.864	77%	0.765	S	S	*	*	S	Bend	trans	69.3	81	-173.3	-55.2	176.2	-23	0	0	114.9
143	L	22.9	Very low	24.4	Very low	173 Å²	173	159.3 Å²	159.3	91%	0.906	76%	0.759	S	S	*	*	S	Bend	trans	-175.7	143.6	139	-98.9	153.2	0	0	0	110
144	S	25.1	Very low	24.6	Very low	58 Å²	58	154.8 Å²	154.8	41%	0.406	76%	0.757	S	S	.	*			trans	59.9	90.3	172.4	170.2	0	0	0	0	118.2	E146 H147	S144-E146 PolarHBondContact OG-N 2.99Å; S144-H147 VanDerWaalsContact OG-CB 3.29Å; S144-H147 WeakPolarHBondContact OG-CB 3.4Å; S144-H147 PolarHBondContact OG-N 3.15Å
145	Y	24.9	Very low	24.7	Very low	230 Å²	230	156.8 Å²	156.8	90%	0.902	76%	0.763	S	S	*	*	S	Bend	trans	-89	16.1	143.2	-150.5	-99.5	0	0	0	111.3
146	E	26	Very low	25	Very low	158 Å²	158	157 Å²	157	74%	0.738	77%	0.766	S	S	*	*	S	Bend	trans	-129.1	-12.1	-164.3	-64.7	-175.4	145.4	0	0	115.3	S144	S144-E146 PolarHBondContact OG-N 2.99Å
147	H	24.4	Very low	24.9	Very low	136 Å²	136	158.2 Å²	158.2	63%	0.63	77%	0.769	S	S	*	*	S	Bend	trans	-91.4	-14	179.4	-73.7	173.7	0	0	0	116.1	S144	S144-H147 VanDerWaalsContact OG-CB 3.29Å; S144-H147 WeakPolarHBondContact OG-CB 3.4Å; S144-H147 PolarHBondContact OG-N 3.15Å
148	T	25.5	Very low	24.9	Very low	124 Å²	124	159.3 Å²	159.3	76%	0.761	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-17.8	-179.3	48	0	0	0	0	114.1
149	T	27.4	Very low	25	Very low	103 Å²	103	154.9 Å²	154.9	63%	0.632	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-21.7	172.3	33.7	0	0	0	0	113.4
150	S	25.8	Very low	25.1	Very low	73 Å²	73	150.8 Å²	150.8	51%	0.51	76%	0.756	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.4	-37.3	-179.8	-178.8	0	0	0	0	113.6	F152 H153	S150-F152 VanDerWaalsContact C-N 3.28Å; S150-F152 PolarHBondContact O-N 3.24Å; S150-H153 PolarHBondContact O-N 3.2Å
151	L	25.6	Very low	25.1	Very low	148 Å²	148	146.8 Å²	146.8	78%	0.775	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-11.4	-176.3	-118.1	78.2	0	0	0	115.2
152	F	26.5	Very low	25.2	Very low	178 Å²	178	148.5 Å²	148.5	78%	0.781	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-12.3	-179.9	-129.3	-93.1	0	0	0	113.9	S150	S150-F152 VanDerWaalsContact C-N 3.28Å; S150-F152 PolarHBondContact O-N 3.24Å
153	H	26.3	Very low	25.4	Very low	166 Å²	166	147.5 Å²	147.5	77%	0.769	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-11.5	180	-87	41.3	0	0	0	114.3	S150	S150-H153 PolarHBondContact O-N 3.2Å
154	S	25.3	Very low	25.5	Very low	107 Å²	107	148.8 Å²	148.8	75%	0.748	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	10.5	-173.3	-148.2	0	0	0	0	115.4
155	K	26.6	Very low	25.5	Very low	198 Å²	198	153.7 Å²	153.7	86%	0.861	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	14.8	174.8	-79.3	-173.2	175.2	178.2	0	114.8
156	M	27.7	Very low	25.5	Very low	173 Å²	173	149.8 Å²	149.8	85%	0.852	75%	0.748	S	S	*	*			trans	-114.3	18.8	175.3	-78.6	-71.8	-174	0	0	113.3
157	K	24.2	Very low	25.3	Very low	189 Å²	189	152.7 Å²	152.7	82%	0.822	75%	0.752	S	S	*	*			trans	-96.5	101.5	161.1	-81.3	-172.8	174.6	-177.9	0	109.1
158	H	24.5	Very low	25.3	Very low	183 Å²	183	154.4 Å²	154.4	85%	0.847	76%	0.764	S	S	*	*			trans	178.6	147.6	132.9	-93.1	-66.8	0	0	0	109.8
159	N	24.8	Very low	25.1	Very low	141 Å²	141	154.2 Å²	154.2	75%	0.754	77%	0.766	S	S	*	*			trans	71.2	74.7	178	-61.6	1	0	0	0	116.1
160	T	24.2	Very low	25	Very low	100 Å²	100	155.4 Å²	155.4	61%	0.613	78%	0.776	S	S	*	*				74.9	105.2	79.9	64.3	0	0	0	0	114.9
161	N	24.2	Very low	24.8	Very low	98 Å²	98	159.4 Å²	159.4	52%	0.524	79%	0.792	S	S	.	*				-171.2	80.9	114.6	-94.1	-16.6	0	0	0	110.8	Q163	N161-Q163 PolarHBondContact O-N 3.01Å
162	E	25	Very low	24.7	Very low	198 Å²	198	160 Å²	160	93%	0.925	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	28.9	171.7	-64.4	177.2	126.7	0	0	113.1
163	Q	25.7	Very low	24.5	Very low	164 Å²	164	156.1 Å²	156.1	77%	0.766	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	10.2	-172.1	-71.7	-167.1	-17.5	0	0	114.8	N161	N161-Q163 PolarHBondContact O-N 3.01Å
164	Y	25	Very low	24.4	Very low	200 Å²	200	155.3 Å²	155.3	78%	0.784	79%	0.792	S	S	*	*	S	Bend	trans	-122.6	12.2	-177.4	-108.6	-84.7	0	0	0	116.1
165	I	26.1	Very low	24.3	Very low	160 Å²	160	158.3 Å²	158.3	82%	0.821	79%	0.794	S	S	*	*	S	Bend	trans	-92.4	-18.3	173.3	-63.6	-179.7	0	0	0	111.7	R167	I165-R167 PolarHBondContact O-N 3.42Å
166	N	24.3	Very low	24.1	Very low	148 Å²	148	156 Å²	156	79%	0.791	79%	0.792	S	S	*	*	S	Bend	trans	-95.8	77.4	176.9	-67.4	-12.3	0	0	0	111.9
167	R	22.5	Very low	23.9	Very low	219 Å²	219	154.9 Å²	154.9	83%	0.826	79%	0.789	S	S	*	*	S	Bend	trans	-175.7	104.7	159.8	-101.9	161.1	-145.6	-150.2	6.5	110.1	I165	I165-R167 PolarHBondContact O-N 3.42Å
168	I	23.9	Very low	23.9	Very low	173 Å²	173	151.2 Å²	151.2	89%	0.887	79%	0.787	S	S	*	*	S	Bend	trans	128.8	71.5	170.5	-64.6	154.2	0	0	0	109.2
169	C	22.7	Very low	24	Very low	119 Å²	119	147.5 Å²	147.5	80%	0.804	78%	0.777	S	S	*	*			trans	-178.2	104.2	152.2	-104.6	0	0	0	0	104.7
170	P	23.7	Very low	23.9	Very low	128 Å²	128	148.4 Å²	148.4	83%	0.831	78%	0.78	S	S	*	*			trans	-68.3	144.4	168.7	30.5	-32.3	0	0	0	108.6	N172	P170-N172 PolarHBondContact O-N 3.47Å
171	D	21.7	Very low	24	Very low	158 Å²	158	150.9 Å²	150.9	85%	0.845	79%	0.789	S	S	*	*			trans	-56.1	126.5	178.3	-59.6	-71.7	0	0	0	111
172	N	24	Very low	24	Very low	159 Å²	159	150.9 Å²	150.9	85%	0.85	79%	0.794	S	S	*	*			trans	-153.1	114.2	143.4	-98.3	-39.2	0	0	0	109.3	P170 N174	P170-N172 PolarHBondContact O-N 3.47Å; N172-N174 PolarHBondContact O-N 3.42Å
173	S	22.4	Very low	24	Very low	98 Å²	98	146.4 Å²	146.4	69%	0.685	78%	0.783	S	S	*	*			trans	-47.3	124	162.4	48.2	0	0	0	0	111.1
174	N	23.9	Very low	24.1	Very low	148 Å²	148	144.4 Å²	144.4	79%	0.791	78%	0.777	S	S	*	*				-170.1	156.8	121.2	-90.4	-26.5	0	0	0	112.2	N172	N172-N174 PolarHBondContact O-N 3.42Å
175	Q	23.5	Very low	24.1	Very low	170 Å²	170	139.2 Å²	139.2	79%	0.794	76%	0.763	S	S	*	*	S	Bend	trans	-47.4	143.8	-173.8	-63.8	150.9	-15.5	0	0	115.1
176	N	22.8	Very low	24.2	Very low	151 Å²	151	136.2 Å²	136.2	81%	0.807	76%	0.755	S	S	*	*			trans	62.9	107.6	172.8	-52.1	-30.6	0	0	0	115.6
177	D	23.3	Very low	24.4	Very low	148 Å²	148	136.9 Å²	136.9	79%	0.791	75%	0.751	S	S	*	*			trans	-162.3	124.8	139.1	-108.5	-28.7	0	0	0	114.9	V179	D177-V179 HydrophobicContact CB-CG2 4.34Å; D177-V179 PolarHBondContact O-N 2.91Å
178	S	24.7	Very low	24.6	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	73%	0.726	S	S	*	*			trans	-89.3	58.6	-176.4	43.9	0	0	0	0	112.6
179	V	25.2	Very low	24.8	Very low	105 Å²	105	124.3 Å²	124.3	64%	0.636	70%	0.703	S	S	*	*			trans	-137.9	54.4	-167.8	-158.7	0	0	0	0	115.2	D177	D177-V179 HydrophobicContact CB-CG2 4.34Å; D177-V179 PolarHBondContact O-N 2.91Å
180	I	23.7	Very low	25.1	Very low	160 Å²	160	126.9 Å²	126.9	82%	0.821	70%	0.703	S	S	*	*			trans	-135.4	42.4	176.6	-35	-179.7	0	0	0	114.4
181	L	25.6	Very low	25.3	Very low	153 Å²	153	127 Å²	127	80%	0.801	69%	0.692	S	S	*	*			trans	-135.5	21.9	175.8	-140.7	70.5	0	0	0	120.1
182	P	24.3	Very low	25.7	Very low	98 Å²	98	122.7 Å²	122.7	64%	0.636	68%	0.675	S	S	*	*	S	Bend	trans	-93.4	-24	167.5	-11.5	29.5	0	0	0	115.9
183	C	25	Very low	26	Very low	103 Å²	103	118.4 Å²	118.4	70%	0.696	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-22.2	-159.9	-159.8	0	0	0	0	115.4
184	L	27.1	Very low	26.4	Very low	122 Å²	122	120.3 Å²	120.3	64%	0.639	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-26.1	-178	-78.2	161.6	0	0	0	113.9	C186 K187 T188	L184-C186 VanDerWaalsContact C-N 3.31Å; L184-C186 PolarHBondContact O-N 2.93Å; L184-K187 PolarHBondContact O-N 3.15Å; L184-T188 PolarHBondContact O-OG1 2.95Å
185	L	26.8	Very low	26.7	Very low	92 Å²	92	118.2 Å²	118.2	48%	0.482	63%	0.634	S	S	.	*	H	α-helix	trans	-60.2	-39.8	177.2	-114.6	71.8	0	0	0	112.1	K187 T188 I189	L185-K187 VanDerWaalsContact C-N 3.28Å; L185-K187 PolarHBondContact O-N 3.24Å; L185-T188 PolarHBondContact O-N 3.25Å; L185-T188 PolarHBondContact O-OG1 3.21Å; L185-I189 VanDerWaalsContact O-CD1 3.26Å; L185-I189 WeakPolarHBondContact O-CD1 3.45Å; L185-I189 VanDerWaalsContact O-CG1 3.26Å; L185-I189 WeakPolarHBondContact O-CG1 3.38Å; L185-I189 PolarHBondContact O-N 2.93Å
186	C	27.2	Very low	27.1	Very low	97 Å²	97	114.2 Å²	114.2	66%	0.655	62%	0.618	S	S	*	*	H	α-helix	trans	-69.6	-20.3	-174.3	-64.1	0	0	0	0	114.2	L184	L184-C186 VanDerWaalsContact C-N 3.31Å; L184-C186 PolarHBondContact O-N 2.93Å
187	K	27.9	Very low	27.6	Very low	161 Å²	161	110.1 Å²	110.1	70%	0.7	60%	0.595	S	S	*	*	H	α-helix	trans	-91.3	-28.8	179.4	-76.1	180	176.7	173.9	0	113.6	L184 L185	L184-K187 PolarHBondContact O-N 3.15Å; L185-K187 VanDerWaalsContact C-N 3.28Å; L185-K187 PolarHBondContact O-N 3.24Å
188	T	27.7	Very low	28.3	Very low	50 Å²	50	107.7 Å²	107.7	31%	0.307	58%	0.582	S	S	.	*	H	α-helix	trans	-82.6	-24.5	-178	49.6	0	0	0	0	113	L184 L185 Q190 Q191	L184-T188 PolarHBondContact O-OG1 2.95Å; L185-T188 PolarHBondContact O-N 3.25Å; L185-T188 PolarHBondContact O-OG1 3.21Å; T188-Q190 PolarHBondContact O-N 2.97Å; T188-Q191 PolarHBondContact O-N 3.44Å
189	I	28	Very low	28.8	Very low	79 Å²	79	105.7 Å²	105.7	41%	0.405	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-20.6	-179.8	-75.4	167.4	0	0	0	114	L185 Q191 Y262	L185-I189 VanDerWaalsContact O-CD1 3.26Å; L185-I189 WeakPolarHBondContact O-CD1 3.45Å; L185-I189 VanDerWaalsContact O-CG1 3.26Å; L185-I189 WeakPolarHBondContact O-CG1 3.38Å; L185-I189 PolarHBondContact O-N 2.93Å; I189-Q191 VanDerWaalsContact C-N 3.32Å; I189-Q191 PolarHBondContact O-N 2.94Å; I189-Y262 VanDerWaalsContact CG2-OH 3.26Å; I189-Y262 WeakPolarHBondContact CG2-OH 3.26Å
190	Q	29	Very low	29.2	Very low	173 Å²	173	103.5 Å²	103.5	81%	0.808	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.5	178.1	-71.8	-174.3	-18.6	0	0	114.4	T188	T188-Q190 PolarHBondContact O-N 2.97Å
191	Q	27.6	Very low	29.7	Very low	129 Å²	129	101 Å²	101	60%	0.603	53%	0.529	S	S	*	.	S	Bend	trans	-122.7	65.8	-166.3	-63.9	-171.7	-4.1	0	0	114.2	T188 I189 H195	T188-Q191 PolarHBondContact O-N 3.44Å; I189-Q191 VanDerWaalsContact C-N 3.32Å; I189-Q191 PolarHBondContact O-N 2.94Å; Q191-H195 PolarHBondContact O-CD2 3.04Å
192	S	29.5	Very low	30	Very low	68 Å²	68	97.7 Å²	97.7	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	67.7	150.3	168.4	87.3	0	0	0	0	117	Y194 H195	S192-Y194 PolarHBondContact O-N 3.28Å; S192-Y194 VanDerWaalsContact O-N 3.09Å; S192-H195 PolarHBondContact O-N 3.23Å
193	P	31	Very low	30.4	Very low	69 Å²	69	96.2 Å²	96.2	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-15.2	-179.2	21.7	-30.7	0	0	0	114.9	L197	P193-L197 PolarHBondContact O-N 3.4Å
194	Y	29.9	Very low	30.7	Very low	138 Å²	138	95.5 Å²	95.5	54%	0.541	49%	0.485	S	S	.	.	H	α-helix	trans	-72.3	-32.8	177.4	-70.5	-81.4	0	0	0	113	S192 L197 N198	S192-Y194 PolarHBondContact O-N 3.28Å; S192-Y194 VanDerWaalsContact O-N 3.09Å; Y194-L197 PolarHBondContact O-N 3.07Å; Y194-N198 PolarHBondContact O-N 3.04Å
195	H	31.7	Very low	31	Very low	105 Å²	105	94.5 Å²	94.5	49%	0.486	48%	0.477	S	S	.	.	H	α-helix	trans	-72.7	-32.4	177.6	-84.4	-80.5	0	0	0	112.8	Q191 S192 L197 H199	Q191-H195 PolarHBondContact O-CD2 3.04Å; S192-H195 PolarHBondContact O-N 3.23Å; H195-L197 VanDerWaalsContact C-N 3.35Å; H195-H199 WeakPolarHBondContact O-CB 3.48Å; H195-H199 PolarHBondContact O-N 3.45Å
196	L	32.1	Very low	31.1	Very low	86 Å²	86	94.9 Å²	94.9	45%	0.45	48%	0.479	S	S	.	.	H	α-helix	trans	-65.5	-39.5	175	-167.5	72.3	0	0	0	111.4	H199 L200	L196-H199 PolarHBondContact O-N 3.21Å; L196-L200 HydrophobicContact CG-CD1 4.2Å; L196-L200 WeakPolarHBondContact O-CB 3.24Å; L196-L200 VanDerWaalsContact O-CG 3.29Å; L196-L200 WeakPolarHBondContact O-CG 3.48Å; L196-L200 PolarHBondContact O-N 3.41Å
197	L	32.8	Very low	31.2	Very low	65 Å²	65	94 Å²	94	34%	0.34	47%	0.468	S	S	.	.	H	α-helix	trans	-61.6	-52.2	175.6	-77.2	161.6	0	0	0	111.6	P193 Y194 H195 H199 L200 E201 F275	P193-L197 PolarHBondContact O-N 3.4Å; Y194-L197 PolarHBondContact O-N 3.07Å; H195-L197 VanDerWaalsContact C-N 3.35Å; L197-H199 VanDerWaalsContact C-N 3.28Å; L197-H199 PolarHBondContact O-N 3.13Å; L197-L200 PolarHBondContact O-N 3.49Å; L197-E201 WeakPolarHBondContact O-CB 3.41Å; L197-E201 PolarHBondContact O-N 3.24Å; L197-F275 HydrophobicContact CD2-CD2 3.82Å; L197-F275 HydrophobicContact CD2-CE2 4.41Å
198	N	36.7	Very low	31.3	Very low	96 Å²	96	88.9 Å²	88.9	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-57.8	-39.5	175.1	-90.2	21	0	0	0	112.5	Y194 E201 N202	Y194-N198 PolarHBondContact O-N 3.04Å; N198-E201 PolarHBondContact O-N 3.22Å; N198-N202 WeakPolarHBondContact O-CB 3.34Å; N198-N202 PolarHBondContact O-N 2.85Å; N198-N202 PolarHBondContact O-ND2 3.26Å; N198-N202 PolarHBondContact O-OD1 2.87Å
199	H	35.1	Very low	31.3	Very low	71 Å²	71	91.2 Å²	91.2	33%	0.329	46%	0.463	S	S	.	.	H	α-helix	trans	-71.6	-33.3	-177.3	-154.3	-41.6	0	0	0	112.6	H195 L196 L197 I203	H195-H199 WeakPolarHBondContact O-CB 3.48Å; H195-H199 PolarHBondContact O-N 3.45Å; L196-H199 PolarHBondContact O-N 3.21Å; L197-H199 VanDerWaalsContact C-N 3.28Å; L197-H199 PolarHBondContact O-N 3.13Å; H199-I203 WeakPolarHBondContact O-CD1 3.39Å; H199-I203 VanDerWaalsContact O-CG1 3.26Å; H199-I203 WeakPolarHBondContact O-CG1 3.48Å; H199-I203 PolarHBondContact O-N 2.84Å; H199-I203 VanDerWaalsContact O-N 3.15Å
200	L	33.9	Very low	31.4	Very low	58 Å²	58	93.4 Å²	93.4	30%	0.304	47%	0.471	S	S	.	.	H	α-helix	trans	-73.1	-36.5	172.8	-69.8	169.4	0	0	0	111.8	L196 L197 I203 H204 F275	L196-L200 HydrophobicContact CG-CD1 4.2Å; L196-L200 WeakPolarHBondContact O-CB 3.24Å; L196-L200 VanDerWaalsContact O-CG 3.29Å; L196-L200 WeakPolarHBondContact O-CG 3.48Å; L196-L200 PolarHBondContact O-N 3.41Å; L197-L200 PolarHBondContact O-N 3.49Å; L200-I203 PolarHBondContact O-N 2.91Å; L200-H204 PolarHBondContact O-N 3.07Å; L200-F275 HydrophobicContact CB-CE2 4.11Å; L200-F275 HydrophobicContact CB-CZ 3.72Å; L200-F275 HydrophobicContact CD1-CE1 4.35Å; L200-F275 HydrophobicContact CD1-CZ 4.19Å
201	E	33.9	Very low	31.2	Very low	107 Å²	107	92.2 Å²	92.2	50%	0.5	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-42.2	173.8	-166.2	163.3	-157.8	0	0	111.2	L197 N198 H204 Q205	L197-E201 WeakPolarHBondContact O-CB 3.41Å; L197-E201 PolarHBondContact O-N 3.24Å; N198-E201 PolarHBondContact O-N 3.22Å; E201-H204 PolarHBondContact O-N 2.81Å; E201-Q205 WeakPolarHBondContact O-CG 3.35Å; E201-Q205 PolarHBondContact O-N 3.49Å
202	N	32.7	Very low	31.1	Very low	85 Å²	85	89.7 Å²	89.7	46%	0.455	46%	0.457	S	S	.	.	H	α-helix	trans	-62.2	-42.3	172.9	-71.4	-13.4	0	0	0	112.9	N198 H204 Q205 I206	N198-N202 WeakPolarHBondContact O-CB 3.34Å; N198-N202 PolarHBondContact O-N 2.85Å; N198-N202 PolarHBondContact O-ND2 3.26Å; N198-N202 PolarHBondContact O-OD1 2.87Å; N202-H204 VanDerWaalsContact C-N 3.33Å; N202-Q205 PolarHBondContact O-N 2.98Å; N202-I206 VanDerWaalsContact O-CG1 3.32Å; N202-I206 WeakPolarHBondContact O-CG1 3.19Å; N202-I206 PolarHBondContact O-N 2.97Å
203	I	32.3	Very low	31	Very low	67 Å²	67	91.1 Å²	91.1	34%	0.344	46%	0.463	S	S	.	.	H	α-helix	trans	-64.2	-40.2	176.2	-70.1	163.1	0	0	0	110.6	H199 L200 I206 N207	H199-I203 WeakPolarHBondContact O-CD1 3.39Å; H199-I203 VanDerWaalsContact O-CG1 3.26Å; H199-I203 WeakPolarHBondContact O-CG1 3.48Å; H199-I203 PolarHBondContact O-N 2.84Å; H199-I203 VanDerWaalsContact O-N 3.15Å; L200-I203 PolarHBondContact O-N 2.91Å; I203-I206 PolarHBondContact O-N 3.2Å; I203-N207 VanDerWaalsContact O-CG 3.28Å; I203-N207 PolarHBondContact O-N 3.1Å; I203-N207 VanDerWaalsContact O-N 3.09Å; I203-N207 PolarHBondContact O-ND2 3.28Å
204	H	32.5	Very low	30.8	Very low	87 Å²	87	95.3 Å²	95.3	40%	0.403	48%	0.477	S	S	.	.	H	α-helix	trans	-66.7	-36.9	174.7	-94.2	-80.9	0	0	0	113.1	L200 E201 N202 N207 S208	L200-H204 PolarHBondContact O-N 3.07Å; E201-H204 PolarHBondContact O-N 2.81Å; N202-H204 VanDerWaalsContact C-N 3.33Å; H204-N207 PolarHBondContact O-N 3.32Å; H204-S208 WeakPolarHBondContact O-CB 3.49Å; H204-S208 PolarHBondContact O-N 3.17Å; H204-S208 PolarHBondContact O-OG 2.66Å
205	Q	33.4	Very low	30.8	Very low	101 Å²	101	95.8 Å²	95.8	47%	0.472	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-39.3	174.8	-74.2	178.1	13.7	0	0	112.4	E201 N202 S208 N209	E201-Q205 WeakPolarHBondContact O-CG 3.35Å; E201-Q205 PolarHBondContact O-N 3.49Å; N202-Q205 PolarHBondContact O-N 2.98Å; Q205-S208 WeakPolarHBondContact CA-OG 3.35Å; Q205-S208 PolarHBondContact O-OG 3.43Å; Q205-S208 VanDerWaalsContact O-OG 3.08Å; Q205-N209 VanDerWaalsContact O-CB 3.31Å; Q205-N209 WeakPolarHBondContact O-CB 3.41Å; Q205-N209 PolarHBondContact O-N 3.11Å; Q205-N209 PolarHBondContact O-ND2 3.38Å; Q205-N209 PolarHBondContact O-OD1 3.06Å
206	I	28.6	Very low	30.4	Very low	101 Å²	101	100.9 Å²	100.9	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-47.2	174.2	-68	162.7	0	0	0	110.2	N202 I203 N209 Q210	N202-I206 VanDerWaalsContact O-CG1 3.32Å; N202-I206 WeakPolarHBondContact O-CG1 3.19Å; N202-I206 PolarHBondContact O-N 2.97Å; I203-I206 PolarHBondContact O-N 3.2Å; I206-N209 PolarHBondContact O-N 3.5Å; I206-Q210 PolarHBondContact O-N 3.47Å
207	N	29	Very low	30.3	Very low	78 Å²	78	103.7 Å²	103.7	42%	0.417	51%	0.514	S	S	.	.	H	α-helix	trans	-69.3	-36.9	-179.9	-67.1	-18.2	0	0	0	113	I203 H204 F211	I203-N207 VanDerWaalsContact O-CG 3.28Å; I203-N207 PolarHBondContact O-N 3.1Å; I203-N207 VanDerWaalsContact O-N 3.09Å; I203-N207 PolarHBondContact O-ND2 3.28Å; H204-N207 PolarHBondContact O-N 3.32Å; N207-F211 PolarHBondContact O-N 2.85Å; N207-F211 VanDerWaalsContact O-N 3.17Å
208	S	30.4	Very low	30	Very low	53 Å²	53	106.3 Å²	106.3	37%	0.371	54%	0.536	S	S	.	.	H	α-helix	trans	-68	-38.9	176.9	63.4	0	0	0	0	111.7	H204 Q205 Q210 F211 T212	H204-S208 WeakPolarHBondContact O-CB 3.49Å; H204-S208 PolarHBondContact O-N 3.17Å; H204-S208 PolarHBondContact O-OG 2.66Å; Q205-S208 WeakPolarHBondContact CA-OG 3.35Å; Q205-S208 PolarHBondContact O-OG 3.43Å; Q205-S208 VanDerWaalsContact O-OG 3.08Å; S208-Q210 VanDerWaalsContact C-N 3.33Å; S208-Q210 PolarHBondContact O-N 3.44Å; S208-F211 PolarHBondContact O-N 2.95Å; S208-T212 WeakPolarHBondContact O-CG2 3.47Å; S208-T212 PolarHBondContact O-N 3.36Å; S208-T212 PolarHBondContact O-OG1 3.47Å
209	N	28.1	Very low	29.4	Very low	100 Å²	100	110.1 Å²	110.1	54%	0.535	55%	0.551	S	S	.	*	H	α-helix	trans	-68.1	-34.1	-177.5	-68.1	-5.7	0	0	0	111.8	Q205 I206 T212 T213	Q205-N209 VanDerWaalsContact O-CB 3.31Å; Q205-N209 WeakPolarHBondContact O-CB 3.41Å; Q205-N209 PolarHBondContact O-N 3.11Å; Q205-N209 PolarHBondContact O-ND2 3.38Å; Q205-N209 PolarHBondContact O-OD1 3.06Å; I206-N209 PolarHBondContact O-N 3.5Å; N209-T212 PolarHBondContact O-OG1 3.35Å; N209-T213 PolarHBondContact O-N 3.27Å; N209-T213 PolarHBondContact O-OG1 3.35Å
210	Q	28.8	Very low	29	Very low	124 Å²	124	114.4 Å²	114.4	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-69.9	-43.4	171.6	-70.5	179.7	-31.4	0	0	112.4	I206 S208 T212 T213	I206-Q210 PolarHBondContact O-N 3.47Å; S208-Q210 VanDerWaalsContact C-N 3.33Å; S208-Q210 PolarHBondContact O-N 3.44Å; Q210-T212 VanDerWaalsContact C-N 3.3Å; Q210-T212 PolarHBondContact O-N 3.39Å; Q210-T213 PolarHBondContact O-N 2.91Å; Q210-T213 PolarHBondContact O-OG1 3.13Å
211	F	25.7	Very low	28.7	Very low	148 Å²	148	118.2 Å²	118.2	65%	0.649	60%	0.595	S	S	*	*	H	α-helix	trans	-64.7	-29.3	176.4	-100.6	-90	0	0	0	113.9	N207 S208	N207-F211 PolarHBondContact O-N 2.85Å; N207-F211 VanDerWaalsContact O-N 3.17Å; S208-F211 PolarHBondContact O-N 2.95Å
212	T	25.9	Very low	28.4	Very low	77 Å²	77	118 Å²	118	47%	0.472	60%	0.603	S	S	.	*	H	α-helix	trans	-84.3	-15.2	-179.5	53.2	0	0	0	0	115	S208 N209 Q210	S208-T212 WeakPolarHBondContact O-CG2 3.47Å; S208-T212 PolarHBondContact O-N 3.36Å; S208-T212 PolarHBondContact O-OG1 3.47Å; N209-T212 PolarHBondContact O-OG1 3.35Å; Q210-T212 VanDerWaalsContact C-N 3.3Å; Q210-T212 PolarHBondContact O-N 3.39Å
213	T	26.9	Very low	28.2	Very low	97 Å²	97	122.9 Å²	122.9	60%	0.595	62%	0.623	S	S	*	*	H	α-helix	trans	-83.6	-29.1	175.7	35.9	0	0	0	0	113.5	N209 Q210	N209-T213 PolarHBondContact O-N 3.27Å; N209-T213 PolarHBondContact O-OG1 3.35Å; Q210-T213 PolarHBondContact O-N 2.91Å; Q210-T213 PolarHBondContact O-OG1 3.13Å
214	E	26.1	Very low	28.3	Very low	157 Å²	157	125.4 Å²	125.4	73%	0.734	64%	0.642	S	S	*	*	H	α-helix	trans	-85.6	-23.7	-178.5	-64.8	-178.9	166.7	0	0	112.7	R216	E214-R216 PolarHBondContact O-N 3.47Å
215	H	29.3	Very low	28.4	Very low	149 Å²	149	126.5 Å²	126.5	69%	0.69	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	12.9	-179.5	-89.8	-66.5	0	0	0	115.8
216	R	25	Very low	28.3	Very low	211 Å²	211	128.4 Å²	128.4	80%	0.796	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	3	-179	-77	-174.8	175.8	-176.1	-0.5	116	E214	E214-R216 PolarHBondContact O-N 3.47Å
217	N	29.1	Very low	28.5	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	66%	0.658	S	S	*	*	S	Bend	trans	-116.7	12.1	-174.4	-74.1	-9	0	0	0	115.1
218	C	26.2	Very low	28.9	Very low	119 Å²	119	130.1 Å²	130.1	80%	0.804	66%	0.664	S	S	*	*			trans	-122.4	51.9	-174.3	-64.3	0	0	0	0	113.5
219	E	24.1	Very low	29	Very low	177 Å²	177	133 Å²	133	83%	0.827	67%	0.671	S	S	*	*			trans	-107.3	134.5	157.9	-68.2	-177	162.4	0	0	108.1
220	N	27.7	Very low	29.3	Very low	160 Å²	160	135.4 Å²	135.4	86%	0.856	67%	0.673	S	S	*	*			trans	84.3	68	-179.6	-44.4	-65.9	0	0	0	118.8
221	I	27.7	Very low	29.8	Very low	138 Å²	138	136.2 Å²	136.2	71%	0.708	68%	0.677	S	S	*	*			trans	-136.3	128.7	152.3	-56.4	-177.4	0	0	0	109.9
222	P	26.3	Very low	30.4	Very low	103 Å²	103	135.1 Å²	135.1	67%	0.669	67%	0.673	S	S	*	*			trans	-73.8	161.9	-175.4	-20.1	34.1	0	0	0	117	T224	P222-T224 PolarHBondContact O-N 3.05Å
223	E	28.9	Very low	30.9	Very low	187 Å²	187	137.8 Å²	137.8	87%	0.874	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	0.2	-171.1	-90.6	177.4	137.2	0	0	118.6
224	T	34.5	Very low	31.4	Very low	120 Å²	120	140.1 Å²	140.1	74%	0.736	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-11.1	-174	46.2	0	0	0	0	115.3	P222	P222-T224 PolarHBondContact O-N 3.05Å
225	Q	34.7	Very low	31.8	Very low	110 Å²	110	140.3 Å²	140.3	51%	0.514	69%	0.686	S	S	.	*	S	Bend	trans	-85.7	-19.5	178.3	-92.4	165.9	-82.5	0	0	114.8	N227 I228	Q225-N227 PolarHBondContact O-N 2.83Å; Q225-N227 VanDerWaalsContact O-N 3.1Å; Q225-I228 PolarHBondContact O-N 3.11Å
226	F	30.2	Very low	31.8	Very low	141 Å²	141	139.4 Å²	139.4	62%	0.618	68%	0.683	S	S	*	*	H	α-helix	trans	-68.2	-15.3	-170.1	-149.9	-101.2	0	0	0	115.2
227	N	33.8	Very low	31.9	Very low	112 Å²	112	136.4 Å²	136.4	60%	0.599	68%	0.683	S	S	*	*	H	α-helix	trans	-96	-14.3	-177.2	-72.8	-36.4	0	0	0	114.5	Q225	Q225-N227 PolarHBondContact O-N 2.83Å; Q225-N227 VanDerWaalsContact O-N 3.1Å
228	I	38.3	Very low	31.8	Very low	104 Å²	104	134.4 Å²	134.4	53%	0.533	68%	0.68	S	S	.	*	H	α-helix	trans	-87.5	-39.9	178.7	-62	176	0	0	0	110.3	Q225 R230 Q231 Q232	Q225-I228 PolarHBondContact O-N 3.11Å; I228-R230 VanDerWaalsContact C-N 3.35Å; I228-R230 PolarHBondContact O-N 3.24Å; I228-Q231 PolarHBondContact O-N 2.92Å; I228-Q232 PolarHBondContact O-N 3.48Å
229	E	32	Very low	31.8	Very low	112 Å²	112	133.6 Å²	133.6	52%	0.523	68%	0.676	S	S	.	*	H	α-helix	trans	-64.4	-37.5	177.5	-64.8	178.9	162.6	0	0	112	Q231 Q232 Q233	E229-Q231 VanDerWaalsContact C-N 3.31Å; E229-Q231 PolarHBondContact O-N 3.36Å; E229-Q232 PolarHBondContact O-N 3.29Å; E229-Q232 VanDerWaalsContact O-N 3.16Å; E229-Q233 PolarHBondContact O-N 3.08Å
230	R	33.3	Very low	31.9	Very low	152 Å²	152	130.5 Å²	130.5	57%	0.574	67%	0.665	S	S	*	*	H	α-helix	trans	-65.2	-29.9	178.2	-170.1	-179.1	-83	-170.8	-4.2	113.4	I228 Q234	I228-R230 VanDerWaalsContact C-N 3.35Å; I228-R230 PolarHBondContact O-N 3.24Å; R230-Q234 WeakPolarHBondContact O-CG 3.49Å
231	Q	39.8	Very low	31.8	Very low	141 Å²	141	133.4 Å²	133.4	66%	0.659	67%	0.67	S	S	*	*	H	α-helix	trans	-78.5	-30.1	174	-73.9	-172.5	-16.1	0	0	112.6	I228 E229	I228-Q231 PolarHBondContact O-N 2.92Å; E229-Q231 VanDerWaalsContact C-N 3.31Å; E229-Q231 PolarHBondContact O-N 3.36Å
232	Q	39.2	Very low	31.7	Very low	124 Å²	124	132.3 Å²	132.3	58%	0.579	66%	0.661	S	S	*	*	H	α-helix	trans	-75.6	-33.5	174.7	-66.6	178.5	3.2	0	0	112	I228 E229 Q234 Q235	I228-Q232 PolarHBondContact O-N 3.48Å; E229-Q232 PolarHBondContact O-N 3.29Å; E229-Q232 VanDerWaalsContact O-N 3.16Å; Q232-Q234 VanDerWaalsContact C-N 3.33Å; Q232-Q234 PolarHBondContact O-N 3.04Å; Q232-Q235 PolarHBondContact O-N 3.31Å
233	Q	36.3	Very low	31.7	Very low	134 Å²	134	131 Å²	131	63%	0.626	65%	0.653	S	S	*	*	H	α-helix	trans	-59.2	-42.2	174.2	-141	95.3	49	0	0	112	E229 Q235 M236	E229-Q233 PolarHBondContact O-N 3.08Å; Q233-Q235 PolarHBondContact O-N 3.47Å; Q233-M236 PolarHBondContact O-N 3.26Å
234	Q	36.3	Very low	31.5	Very low	146 Å²	146	131.1 Å²	131.1	68%	0.682	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-7.9	-176.9	-71.7	179.4	-15.3	0	0	114.6	R230 Q232	R230-Q234 WeakPolarHBondContact O-CG 3.49Å; Q232-Q234 VanDerWaalsContact C-N 3.33Å; Q232-Q234 PolarHBondContact O-N 3.04Å
235	Q	35.7	Very low	31.1	Very low	161 Å²	161	129.6 Å²	129.6	75%	0.752	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-3.7	175.6	-65.6	-173.3	-6.7	0	0	113.4	Q232 Q233	Q232-Q235 PolarHBondContact O-N 3.31Å; Q233-Q235 PolarHBondContact O-N 3.47Å
236	M	27.8	Very low	30.6	Very low	129 Å²	129	129.3 Å²	129.3	64%	0.635	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-10.9	-175.8	-69.3	-75	-81.4	0	0	114.4	Q233 S238	Q233-M236 PolarHBondContact O-N 3.26Å; M236-S238 PolarHBondContact O-N 2.96Å; M236-S238 VanDerWaalsContact O-N 3.11Å
237	D	27.5	Very low	30.4	Very low	149 Å²	149	128.1 Å²	128.1	80%	0.797	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	2.4	-172.1	-83.1	-29.2	0	0	0	115.8
238	S	28.6	Very low	30	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-5.3	-170.7	55.6	0	0	0	0	116.5	M236	M236-S238 PolarHBondContact O-N 2.96Å; M236-S238 VanDerWaalsContact O-N 3.11Å
239	S	25.3	Very low	29.4	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	64%	0.641	S	S	*	*	S	Bend	trans	-137.2	-6.2	-166.7	-62.6	0	0	0	0	118.8
240	L	26.3	Very low	29.1	Very low	113 Å²	113	129.4 Å²	129.4	59%	0.592	64%	0.638	S	S	*	*			trans	-123.9	90.5	-172.1	-78.4	164	0	0	0	114.6	H242	L240-H242 VanDerWaalsContact C-N 3.25Å; L240-H242 PolarHBondContact O-N 2.84Å
241	K	25.9	Very low	28.8	Very low	220 Å²	220	126.9 Å²	126.9	96%	0.957	64%	0.635	S	S	*	*			trans	-70.6	74.1	165.1	-69.2	179.1	177.7	175.9	0	110.8
242	H	25.2	Very low	28.2	Very low	115 Å²	115	123.4 Å²	123.4	53%	0.532	62%	0.623	S	S	.	*			trans	-77.9	146.8	-178.2	-101.7	-61.2	0	0	0	113.7	L240 Y244	L240-H242 VanDerWaalsContact C-N 3.25Å; L240-H242 PolarHBondContact O-N 2.84Å; H242-Y244 VanDerWaalsContact C-N 3.3Å; H242-Y244 PolarHBondContact O-N 3.4Å; H242-Y244 VanDerWaalsContact O-N 3.17Å
243	P	26	Very low	27.7	Very low	77 Å²	77	122.1 Å²	122.1	50%	0.5	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	2.6	-162.4	33	-36.9	0	0	0	115.8	T245 N246	P243-T245 PolarHBondContact O-N 3.25Å; P243-N246 PolarHBondContact O-N 3.42Å
244	Y	24.7	Very low	27.4	Very low	188 Å²	188	121.7 Å²	121.7	74%	0.737	62%	0.618	S	S	*	*	H	α-helix	trans	-75.4	-19.8	-172.8	-72.8	-81.5	0	0	0	114.6	H242	H242-Y244 VanDerWaalsContact C-N 3.3Å; H242-Y244 PolarHBondContact O-N 3.4Å; H242-Y244 VanDerWaalsContact O-N 3.17Å
245	T	25.8	Very low	27.3	Very low	89 Å²	89	119.3 Å²	119.3	55%	0.546	61%	0.61	S	S	.	*	H	α-helix	trans	-69.2	-41.2	174	44.4	0	0	0	0	112	P243 K248 L249	P243-T245 PolarHBondContact O-N 3.25Å; T245-K248 WeakPolarHBondContact O-CB 3.42Å; T245-K248 PolarHBondContact O-N 3.27Å; T245-L249 WeakPolarHBondContact O-CD1 3.31Å; T245-L249 PolarHBondContact O-N 3.46Å; T245-L249 VanDerWaalsContact O-N 3.12Å
246	N	25.7	Very low	27.1	Very low	103 Å²	103	113.7 Å²	113.7	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-64.6	-42.5	-179.5	-74.3	-11.9	0	0	0	112.6	P243 K248 L249 I250	P243-N246 PolarHBondContact O-N 3.42Å; N246-K248 VanDerWaalsContact C-N 3.27Å; N246-K248 PolarHBondContact O-N 3.35Å; N246-L249 PolarHBondContact O-N 3.29Å; N246-I250 WeakPolarHBondContact O-CD1 3.44Å; N246-I250 VanDerWaalsContact O-CG1 3.26Å; N246-I250 WeakPolarHBondContact O-CG1 3.49Å; N246-I250 PolarHBondContact O-N 3.49Å
247	H	25.5	Very low	27.5	Very low	116 Å²	116	111.3 Å²	111.3	54%	0.537	58%	0.582	S	S	.	*	H	α-helix	trans	-60.5	-37.3	175.4	-91.5	-82.8	0	0	0	112.5	I251	H247-I251 WeakPolarHBondContact O-CB 3.31Å; H247-I251 WeakPolarHBondContact O-CD1 3.5Å; H247-I251 VanDerWaalsContact O-CG1 3.24Å; H247-I251 WeakPolarHBondContact O-CG1 3.31Å; H247-I251 PolarHBondContact O-N 3.02Å; H247-I251 VanDerWaalsContact O-N 3.1Å
248	K	25.8	Very low	27.7	Very low	164 Å²	164	107.4 Å²	107.4	71%	0.713	56%	0.562	S	S	*	*	H	α-helix	trans	-66.4	-42.1	177.8	-157.4	176.7	-177.6	-175.3	0	111.5	T245 N246 T252	T245-K248 WeakPolarHBondContact O-CB 3.42Å; T245-K248 PolarHBondContact O-N 3.27Å; N246-K248 VanDerWaalsContact C-N 3.27Å; N246-K248 PolarHBondContact O-N 3.35Å; K248-T252 PolarHBondContact O-N 3.14Å; K248-T252 VanDerWaalsContact O-N 3.16Å; K248-T252 PolarHBondContact O-OG1 3.02Å; K248-T252 VanDerWaalsContact O-OG1 3.1Å
249	L	24.4	Very low	27.8	Very low	102 Å²	102	105.2 Å²	105.2	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-65.3	-45.2	174.7	-92.9	115.4	0	0	0	113.1	T245 N246 I251 T252 D253	T245-L249 WeakPolarHBondContact O-CD1 3.31Å; T245-L249 PolarHBondContact O-N 3.46Å; T245-L249 VanDerWaalsContact O-N 3.12Å; N246-L249 PolarHBondContact O-N 3.29Å; L249-I251 PolarHBondContact O-N 2.89Å; L249-T252 WeakPolarHBondContact CA-OG1 3.29Å; L249-T252 PolarHBondContact O-N 2.94Å; L249-T252 PolarHBondContact O-OG1 3.27Å; L249-D253 PolarHBondContact O-N 3.47Å
250	I	25.3	Very low	28.2	Very low	90 Å²	90	108.9 Å²	108.9	46%	0.462	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-41.5	-179	-66.6	162.1	0	0	0	111.2	N246 D253 Q254	N246-I250 WeakPolarHBondContact O-CD1 3.44Å; N246-I250 VanDerWaalsContact O-CG1 3.26Å; N246-I250 WeakPolarHBondContact O-CG1 3.49Å; N246-I250 PolarHBondContact O-N 3.49Å; I250-D253 PolarHBondContact O-N 3.49Å; I250-Q254 PolarHBondContact O-N 3.21Å
251	I	27	Very low	28.7	Very low	98 Å²	98	111.1 Å²	111.1	50%	0.503	55%	0.546	S	S	.	.	H	α-helix	trans	-64.8	-40.6	176	-68.3	167.1	0	0	0	110.5	H247 L249 L255	H247-I251 WeakPolarHBondContact O-CB 3.31Å; H247-I251 WeakPolarHBondContact O-CD1 3.5Å; H247-I251 VanDerWaalsContact O-CG1 3.24Å; H247-I251 WeakPolarHBondContact O-CG1 3.31Å; H247-I251 PolarHBondContact O-N 3.02Å; H247-I251 VanDerWaalsContact O-N 3.1Å; L249-I251 PolarHBondContact O-N 2.89Å; I251-L255 HydrophobicContact CG2-CD1 3.88Å; I251-L255 VanDerWaalsContact O-CB 3.31Å; I251-L255 WeakPolarHBondContact O-CB 3.46Å; I251-L255 WeakPolarHBondContact O-CD1 3.45Å; I251-L255 VanDerWaalsContact O-CG 3.26Å; I251-L255 WeakPolarHBondContact O-CG 3.4Å; I251-L255 PolarHBondContact O-N 3.24Å
252	T	27.6	Very low	29	Very low	69 Å²	69	105.2 Å²	105.2	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-65.8	-38.6	175.1	46.8	0	0	0	0	112.8	K248 L249 L255 T256	K248-T252 PolarHBondContact O-N 3.14Å; K248-T252 VanDerWaalsContact O-N 3.16Å; K248-T252 PolarHBondContact O-OG1 3.02Å; K248-T252 VanDerWaalsContact O-OG1 3.1Å; L249-T252 WeakPolarHBondContact CA-OG1 3.29Å; L249-T252 PolarHBondContact O-N 2.94Å; L249-T252 PolarHBondContact O-OG1 3.27Å; T252-L255 PolarHBondContact O-N 3.18Å; T252-T256 VanDerWaalsContact O-CG2 3.31Å; T252-T256 WeakPolarHBondContact O-CG2 3.45Å; T252-T256 PolarHBondContact O-N 3.46Å; T252-T256 PolarHBondContact O-OG1 3.32Å; T252-T256 VanDerWaalsContact O-OG1 3.14Å
253	D	28.5	Very low	29.2	Very low	96 Å²	96	102.1 Å²	102.1	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-72.6	-37.6	-179.9	-80	-8.1	0	0	0	113.3	L249 I250 L255 T256 S257	L249-D253 PolarHBondContact O-N 3.47Å; I250-D253 PolarHBondContact O-N 3.49Å; D253-L255 VanDerWaalsContact C-N 3.35Å; D253-T256 WeakPolarHBondContact CA-OG1 3.49Å; D253-T256 PolarHBondContact O-OG1 3.36Å; D253-T256 VanDerWaalsContact O-OG1 3.07Å; D253-S257 WeakPolarHBondContact O-CB 3.43Å; D253-S257 PolarHBondContact O-N 2.99Å
254	Q	31.2	Very low	29.6	Very low	125 Å²	125	107 Å²	107	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-72.1	-31	173.2	-76.8	176.2	-23.4	0	0	112	I250 N258	I250-Q254 PolarHBondContact O-N 3.21Å; Q254-N258 WeakPolarHBondContact O-CB 3.48Å; Q254-N258 PolarHBondContact O-N 3.4Å; Q254-N258 PolarHBondContact O-ND2 3.44Å
255	L	33.4	Very low	29.9	Very low	97 Å²	97	102.7 Å²	102.7	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-56.9	167.3	-76.7	167	0	0	0	110.4	I251 T252 D253 S257 N258 L259	I251-L255 HydrophobicContact CG2-CD1 3.88Å; I251-L255 VanDerWaalsContact O-CB 3.31Å; I251-L255 WeakPolarHBondContact O-CB 3.46Å; I251-L255 WeakPolarHBondContact O-CD1 3.45Å; I251-L255 VanDerWaalsContact O-CG 3.26Å; I251-L255 WeakPolarHBondContact O-CG 3.4Å; I251-L255 PolarHBondContact O-N 3.24Å; T252-L255 PolarHBondContact O-N 3.18Å; D253-L255 VanDerWaalsContact C-N 3.35Å; L255-S257 VanDerWaalsContact C-N 3.3Å; L255-S257 PolarHBondContact O-N 3.49Å; L255-N258 CarbonylContact O-C 3.59Å; L255-N258 PolarHBondContact O-N 2.91Å; L255-N258 VanDerWaalsContact O-N 3.09Å; L255-L259 WeakPolarHBondContact O-CB 3.38Å; L255-L259 WeakPolarHBondContact O-CG 3.42Å; L255-L259 PolarHBondContact O-N 3.31Å
256	T	31.2	Very low	29.9	Very low	43 Å²	43	105.4 Å²	105.4	26%	0.264	52%	0.517	S	S	.	.	H	α-helix	trans	-57.6	-39.4	-177.5	55.4	0	0	0	0	112.8	T252 D253 L259 Y260 Y298	T252-T256 VanDerWaalsContact O-CG2 3.31Å; T252-T256 WeakPolarHBondContact O-CG2 3.45Å; T252-T256 PolarHBondContact O-N 3.46Å; T252-T256 PolarHBondContact O-OG1 3.32Å; T252-T256 VanDerWaalsContact O-OG1 3.14Å; D253-T256 WeakPolarHBondContact CA-OG1 3.49Å; D253-T256 PolarHBondContact O-OG1 3.36Å; D253-T256 VanDerWaalsContact O-OG1 3.07Å; T256-L259 PolarHBondContact O-N 3.28Å; T256-Y260 WeakPolarHBondContact O-CB 3.43Å; T256-Y260 PolarHBondContact O-N 3.04Å; T256-Y298 HydrophobicContact CG2-CE1 3.8Å
257	S	36.4	Very low	30.2	Very low	78 Å²	78	105 Å²	105	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-63.6	-45	174.9	-176.5	0	0	0	0	112.7	D253 L255 Y260 K261	D253-S257 WeakPolarHBondContact O-CB 3.43Å; D253-S257 PolarHBondContact O-N 2.99Å; L255-S257 VanDerWaalsContact C-N 3.3Å; L255-S257 PolarHBondContact O-N 3.49Å; S257-Y260 PolarHBondContact O-N 3.08Å; S257-K261 PolarHBondContact O-N 3.02Å; S257-K261 VanDerWaalsContact O-N 3.13Å
258	N	33.1	Very low	30.6	Very low	68 Å²	68	102 Å²	102	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-67.6	-40	174.2	-78.6	-58.4	0	0	0	111.9	Q254 L255 Y260 K261 Y262	Q254-N258 WeakPolarHBondContact O-CB 3.48Å; Q254-N258 PolarHBondContact O-N 3.4Å; Q254-N258 PolarHBondContact O-ND2 3.44Å; L255-N258 CarbonylContact O-C 3.59Å; L255-N258 PolarHBondContact O-N 2.91Å; L255-N258 VanDerWaalsContact O-N 3.09Å; N258-Y260 VanDerWaalsContact C-N 3.33Å; N258-Y260 PolarHBondContact O-N 3.19Å; N258-K261 CarbonylContact O-C 3.54Å; N258-K261 WeakPolarHBondContact O-CA 3.47Å; N258-K261 WeakPolarHBondContact O-CB 3.42Å; N258-K261 PolarHBondContact O-N 3.23Å; N258-Y262 HydrophobicContact CB-CD2 4.39Å; N258-Y262 HydrophobicContact CB-CE2 4.42Å; N258-Y262 WeakPolarHBondContact O-CD2 3.35Å; N258-Y262 PolarHBondContact O-N 3.31Å
259	L	30.5	Very low	31.1	Very low	57 Å²	57	98.2 Å²	98.2	30%	0.298	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-41.6	176.1	-69.9	177.2	0	0	0	111.5	L255 T256 K261 Y262 S263 L272	L255-L259 WeakPolarHBondContact O-CB 3.38Å; L255-L259 WeakPolarHBondContact O-CG 3.42Å; L255-L259 PolarHBondContact O-N 3.31Å; T256-L259 PolarHBondContact O-N 3.28Å; L259-K261 VanDerWaalsContact C-N 3.3Å; L259-K261 PolarHBondContact O-N 3.45Å; L259-Y262 PolarHBondContact O-N 3.49Å; L259-S263 WeakPolarHBondContact O-CB 3.25Å; L259-S263 PolarHBondContact O-N 3.28Å; L259-S263 PolarHBondContact O-OG 3.41Å; L259-L272 HydrophobicContact CD2-CD1 3.5Å; L259-L272 VanDerWaalsContact CD2-CD1 3.5Å; L259-L272 HydrophobicContact CD2-CD2 3.32Å; L259-L272 HydrophobicContact CD2-CG 4.02Å
260	Y	32.8	Very low	31.7	Very low	178 Å²	178	96.8 Å²	96.8	70%	0.698	48%	0.478	S	S	*	.	H	α-helix	trans	-62.9	-36.6	172.8	-170.5	-106.6	0	0	0	112.3	T256 S257 N258 S263	T256-Y260 WeakPolarHBondContact O-CB 3.43Å; T256-Y260 PolarHBondContact O-N 3.04Å; S257-Y260 PolarHBondContact O-N 3.08Å; N258-Y260 VanDerWaalsContact C-N 3.33Å; N258-Y260 PolarHBondContact O-N 3.19Å; Y260-S263 PolarHBondContact O-OG 3.38Å; Y260-S263 VanDerWaalsContact O-OG 3.05Å
261	K	36.3	Very low	32.4	Very low	160 Å²	160	95.1 Å²	95.1	70%	0.696	47%	0.47	S	S	*	.	H	α-helix	trans	-69.9	-37.8	176.8	-149.2	169.7	-173.3	173.7	0	112.5	S257 N258 L259	S257-K261 PolarHBondContact O-N 3.02Å; S257-K261 VanDerWaalsContact O-N 3.13Å; N258-K261 CarbonylContact O-C 3.54Å; N258-K261 WeakPolarHBondContact O-CA 3.47Å; N258-K261 WeakPolarHBondContact O-CB 3.42Å; N258-K261 PolarHBondContact O-N 3.23Å; L259-K261 VanDerWaalsContact C-N 3.3Å; L259-K261 PolarHBondContact O-N 3.45Å
262	Y	32.7	Very low	33	Very low	96 Å²	96	93.2 Å²	93.2	38%	0.376	46%	0.461	S	S	.	.	H	α-helix	trans	-89.4	-21.6	-179.6	-71.3	-66.1	0	0	0	114.7	I189 N258 L259 K264 N265	I189-Y262 VanDerWaalsContact CG2-OH 3.26Å; I189-Y262 WeakPolarHBondContact CG2-OH 3.26Å; N258-Y262 HydrophobicContact CB-CD2 4.39Å; N258-Y262 HydrophobicContact CB-CE2 4.42Å; N258-Y262 WeakPolarHBondContact O-CD2 3.35Å; N258-Y262 PolarHBondContact O-N 3.31Å; L259-Y262 PolarHBondContact O-N 3.49Å; Y262-K264 PolarHBondContact O-N 3.41Å; Y262-N265 PolarHBondContact O-N 3.16Å
263	S	28.8	Very low	33.7	Very low	50 Å²	50	93.4 Å²	93.4	35%	0.35	46%	0.456	S	S	.	.	H	α-helix	trans	-63.4	-22.8	178.5	67.2	0	0	0	0	113.5	L259 Y260 N265	L259-S263 WeakPolarHBondContact O-CB 3.25Å; L259-S263 PolarHBondContact O-N 3.28Å; L259-S263 PolarHBondContact O-OG 3.41Å; Y260-S263 PolarHBondContact O-OG 3.38Å; Y260-S263 VanDerWaalsContact O-OG 3.05Å; S263-N265 PolarHBondContact O-N 2.92Å
264	K	34.1	Very low	34.4	Very low	179 Å²	179	91.6 Å²	91.6	78%	0.778	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.9	169.4	-72.9	-172.6	175.2	-177.5	0	113.5	Y262	Y262-K264 PolarHBondContact O-N 3.41Å
265	N	31.1	Very low	34.9	Very low	99 Å²	99	87.4 Å²	87.4	53%	0.529	43%	0.426	S	S	.	.	S	Bend	trans	-103.9	103.6	168	-91.2	-47.7	0	0	0	111.1	Y262 S263 T267 N268 Y269	Y262-N265 PolarHBondContact O-N 3.16Å; S263-N265 PolarHBondContact O-N 2.92Å; N265-T267 PolarHBondContact O-N 3.49Å; N265-T267 VanDerWaalsContact O-N 3.08Å; N265-N268 HydrophobicContact CB-CB 4.24Å; N265-N268 WeakPolarHBondContact O-CB 3.37Å; N265-N268 PolarHBondContact O-N 3.33Å; N265-Y269 PolarHBondContact O-N 3.27Å
266	F	26	Very low	35.1	Very low	145 Å²	145	85.9 Å²	85.9	64%	0.636	42%	0.417	S	S	*	.	H	α-helix	trans	-51.6	-35.6	-177.5	-156.6	-88.6	0	0	0	113.9	F270	F266-F270 PolarHBondContact O-N 3.05Å; F266-F270 VanDerWaalsContact O-N 3.16Å
267	T	31.9	Very low	35.5	Very low	96 Å²	96	89.9 Å²	89.9	59%	0.589	43%	0.428	S	S	*	.	H	α-helix	trans	-65.9	-36.6	176.8	-41.5	0	0	0	0	112.7	N265 N271	N265-T267 PolarHBondContact O-N 3.49Å; N265-T267 VanDerWaalsContact O-N 3.08Å; T267-N271 VanDerWaalsContact O-CG 3.32Å; T267-N271 PolarHBondContact O-N 3.08Å
268	N	34.9	Very low	35.7	Very low	52 Å²	52	91.8 Å²	91.8	28%	0.278	43%	0.427	S	S	.	.	H	α-helix	trans	-76.6	-38.1	-179.6	-65.3	-7.4	0	0	0	110.6	N265 F270 N271 L272	N265-N268 HydrophobicContact CB-CB 4.24Å; N265-N268 WeakPolarHBondContact O-CB 3.37Å; N265-N268 PolarHBondContact O-N 3.33Å; N268-F270 PolarHBondContact O-N 3.26Å; N268-N271 PolarHBondContact O-N 3.38Å; N268-L272 VanDerWaalsContact O-CB 3.3Å; N268-L272 WeakPolarHBondContact O-CB 3.36Å; N268-L272 PolarHBondContact O-N 2.66Å
269	Y	35.3	Very low	35.7	Very low	84 Å²	84	91.5 Å²	91.5	33%	0.329	43%	0.425	S	S	.	.	H	α-helix	trans	-56.1	-47.9	171.6	-179.7	-91.6	0	0	0	111.7	N265 N271 L272 F273 L299	N265-Y269 PolarHBondContact O-N 3.27Å; Y269-N271 PolarHBondContact O-N 2.98Å; Y269-L272 PolarHBondContact O-N 3.2Å; Y269-F273 HydrophobicContact CE1-CB 4.5Å; Y269-F273 WeakPolarHBondContact O-CB 3.48Å; Y269-F273 PolarHBondContact O-N 2.8Å; Y269-L299 WeakPolarHBondContact OH-CD2 3.46Å
270	F	38	Very low	35.8	Very low	73 Å²	73	93.7 Å²	93.7	32%	0.32	44%	0.437	S	S	.	.	H	α-helix	trans	-62.2	-44.9	178.8	-175.4	-91.4	0	0	0	112.7	F266 N268 F273 N274	F266-F270 PolarHBondContact O-N 3.05Å; F266-F270 VanDerWaalsContact O-N 3.16Å; N268-F270 PolarHBondContact O-N 3.26Å; F270-F273 PolarHBondContact O-N 3.01Å; F270-N274 WeakPolarHBondContact CD1-ND2 3.48Å; F270-N274 WeakPolarHBondContact CE1-ND2 3.41Å; F270-N274 WeakPolarHBondContact CZ-ND2 3.4Å; F270-N274 PolarHBondContact O-N 3.04Å; F270-N274 PolarHBondContact O-ND2 3.44Å
271	N	38.7	Very low	35.8	Very low	54 Å²	54	87.2 Å²	87.2	29%	0.289	41%	0.412	S	S	.	.	H	α-helix	trans	-65.9	-40.3	-179.8	-68.9	-8.9	0	0	0	111.7	T267 N268 Y269 N274 F275	T267-N271 VanDerWaalsContact O-CG 3.32Å; T267-N271 PolarHBondContact O-N 3.08Å; N268-N271 PolarHBondContact O-N 3.38Å; Y269-N271 PolarHBondContact O-N 2.98Å; N271-N274 PolarHBondContact O-N 2.95Å; N271-F275 WeakPolarHBondContact O-CB 3.43Å; N271-F275 PolarHBondContact O-N 2.76Å
272	L	40.2	Very low	35.6	Very low	59 Å²	59	87.9 Å²	87.9	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-70.4	-41.1	177.2	-177.4	118.4	0	0	0	112.3	L259 N268 Y269 N274 F275 M276	L259-L272 HydrophobicContact CD2-CD1 3.5Å; L259-L272 VanDerWaalsContact CD2-CD1 3.5Å; L259-L272 HydrophobicContact CD2-CD2 3.32Å; L259-L272 HydrophobicContact CD2-CG 4.02Å; N268-L272 VanDerWaalsContact O-CB 3.3Å; N268-L272 WeakPolarHBondContact O-CB 3.36Å; N268-L272 PolarHBondContact O-N 2.66Å; Y269-L272 PolarHBondContact O-N 3.2Å; L272-N274 VanDerWaalsContact C-N 3.31Å; L272-N274 PolarHBondContact O-N 3.4Å; L272-F275 WeakPolarHBondContact O-CB 3.32Å; L272-F275 PolarHBondContact O-N 3.44Å; L272-F275 VanDerWaalsContact O-N 3.15Å; L272-M276 HydrophobicContact CD2-SD 3.85Å; L272-M276 HydrophobicContact CG-SD 4.43Å; L272-M276 WeakPolarHBondContact O-CG 3.32Å; L272-M276 PolarHBondContact O-N 3.09Å
273	F	41.6	Very low	35.6	Very low	73 Å²	73	86.9 Å²	86.9	32%	0.32	42%	0.418	S	S	.	.	H	α-helix	trans	-57.4	-45.5	173	178.6	-91.1	0	0	0	110.9	Y269 F270 F275 M276 Y277	Y269-F273 HydrophobicContact CE1-CB 4.5Å; Y269-F273 WeakPolarHBondContact O-CB 3.48Å; Y269-F273 PolarHBondContact O-N 2.8Å; F270-F273 PolarHBondContact O-N 3.01Å; F273-F275 PolarHBondContact O-N 3.47Å; F273-M276 PolarHBondContact O-N 2.89Å; F273-Y277 HydrophobicContact CZ-CD2 4.49Å; F273-Y277 VanDerWaalsContact O-CB 3.24Å; F273-Y277 WeakPolarHBondContact O-CB 3.41Å; F273-Y277 PolarHBondContact O-N 2.98Å
274	N	43.6	Very low	35.5	Very low	57 Å²	57	89.2 Å²	89.2	31%	0.305	42%	0.424	S	S	.	.	H	α-helix	trans	-68.1	-32.4	175.9	-76.7	-82.4	0	0	0	113.3	F270 N271 L272 K278	F270-N274 WeakPolarHBondContact CD1-ND2 3.48Å; F270-N274 WeakPolarHBondContact CE1-ND2 3.41Å; F270-N274 WeakPolarHBondContact CZ-ND2 3.4Å; F270-N274 PolarHBondContact O-N 3.04Å; F270-N274 PolarHBondContact O-ND2 3.44Å; N271-N274 PolarHBondContact O-N 2.95Å; L272-N274 VanDerWaalsContact C-N 3.31Å; L272-N274 PolarHBondContact O-N 3.4Å; N274-K278 WeakPolarHBondContact O-CB 3.31Å; N274-K278 WeakPolarHBondContact O-CG 3.38Å; N274-K278 PolarHBondContact O-N 3.1Å
275	F	41.9	Very low	35.4	Very low	38 Å²	38	85.6 Å²	85.6	17%	0.167	42%	0.419	C	S	.	.	H	α-helix	trans	-66.2	-47.8	173.5	179.3	-85.4	0	0	0	111.1	L197 L200 N271 L272 F273 K278 N279	L197-F275 HydrophobicContact CD2-CD2 3.82Å; L197-F275 HydrophobicContact CD2-CE2 4.41Å; L200-F275 HydrophobicContact CB-CE2 4.11Å; L200-F275 HydrophobicContact CB-CZ 3.72Å; L200-F275 HydrophobicContact CD1-CE1 4.35Å; L200-F275 HydrophobicContact CD1-CZ 4.19Å; N271-F275 WeakPolarHBondContact O-CB 3.43Å; N271-F275 PolarHBondContact O-N 2.76Å; L272-F275 WeakPolarHBondContact O-CB 3.32Å; L272-F275 PolarHBondContact O-N 3.44Å; L272-F275 VanDerWaalsContact O-N 3.15Å; F273-F275 PolarHBondContact O-N 3.47Å; F275-K278 PolarHBondContact O-N 3.38Å; F275-N279 VanDerWaalsContact CD2-ND2 3.27Å; F275-N279 WeakPolarHBondContact CD2-ND2 3.24Å; F275-N279 HydrophobicContact CE1-CB 4.48Å; F275-N279 WeakPolarHBondContact CE2-ND2 3.43Å; F275-N279 WeakPolarHBondContact CZ-ND2 3.27Å; F275-N279 WeakPolarHBondContact O-CB 3.39Å; F275-N279 PolarHBondContact O-N 3.28Å; F275-N279 PolarHBondContact O-ND2 3.48Å
276	M	38.1	Very low	35.6	Very low	64 Å²	64	90.2 Å²	90.2	32%	0.315	43%	0.434	S	S	.	.	H	α-helix	trans	-58.2	-49.8	172.9	-71.3	-178.5	72.9	0	0	110.1	L272 F273 K278 N279 L280 F281	L272-M276 HydrophobicContact CD2-SD 3.85Å; L272-M276 HydrophobicContact CG-SD 4.43Å; L272-M276 WeakPolarHBondContact O-CG 3.32Å; L272-M276 PolarHBondContact O-N 3.09Å; F273-M276 PolarHBondContact O-N 2.89Å; M276-K278 VanDerWaalsContact C-N 3.33Å; M276-K278 PolarHBondContact O-N 2.94Å; M276-N279 PolarHBondContact O-N 3.02Å; M276-L280 HydrophobicContact CB-CD1 4Å; M276-L280 HydrophobicContact CE-CD1 3.78Å; M276-L280 HydrophobicContact CG-CD1 4.03Å; M276-L280 WeakPolarHBondContact O-CB 3.5Å; M276-L280 PolarHBondContact O-N 3.28Å; M276-F281 VanDerWaalsContact O-CD2 3.31Å; M276-F281 WeakPolarHBondContact O-CD2 3.5Å
277	Y	40	Very low	35.9	Very low	127 Å²	127	88.3 Å²	88.3	50%	0.498	43%	0.425	S	S	.	.	H	α-helix	trans	-57.5	-40.4	178.3	-160.9	-96.2	0	0	0	113	F273 F281	F273-Y277 HydrophobicContact CZ-CD2 4.49Å; F273-Y277 VanDerWaalsContact O-CB 3.24Å; F273-Y277 WeakPolarHBondContact O-CB 3.41Å; F273-Y277 PolarHBondContact O-N 2.98Å; Y277-F281 VanDerWaalsContact CA-CD2 3.45Å; Y277-F281 HydrophobicContact CD2-CD2 4.33Å; Y277-F281 HydrophobicContact CD2-CE2 4.43Å; Y277-F281 HydrophobicContact CD2-CG 4.41Å; Y277-F281 WeakPolarHBondContact O-CB 3.48Å
278	K	39.9	Very low	35.8	Very low	118 Å²	118	86.6 Å²	86.6	51%	0.513	41%	0.412	S	S	.	.	H	α-helix	trans	-73.5	-38.3	176.1	-79.5	-175.8	173.4	-177.8	0	113.9	N274 F275 M276 Y282	N274-K278 WeakPolarHBondContact O-CB 3.31Å; N274-K278 WeakPolarHBondContact O-CG 3.38Å; N274-K278 PolarHBondContact O-N 3.1Å; F275-K278 PolarHBondContact O-N 3.38Å; M276-K278 VanDerWaalsContact C-N 3.33Å; M276-K278 PolarHBondContact O-N 2.94Å; K278-Y282 WeakPolarHBondContact O-CB 3.45Å; K278-Y282 VanDerWaalsContact O-CD2 3.24Å; K278-Y282 WeakPolarHBondContact O-CD2 3.46Å
279	N	33.4	Very low	35.7	Very low	63 Å²	63	89.7 Å²	89.7	34%	0.337	43%	0.428	S	S	.	.	H	α-helix	trans	-106.6	-17.9	-164.7	-62.1	-30	0	0	0	114.9	F275 M276 S283	F275-N279 VanDerWaalsContact CD2-ND2 3.27Å; F275-N279 WeakPolarHBondContact CD2-ND2 3.24Å; F275-N279 HydrophobicContact CE1-CB 4.48Å; F275-N279 WeakPolarHBondContact CE2-ND2 3.43Å; F275-N279 WeakPolarHBondContact CZ-ND2 3.27Å; F275-N279 WeakPolarHBondContact O-CB 3.39Å; F275-N279 PolarHBondContact O-N 3.28Å; F275-N279 PolarHBondContact O-ND2 3.48Å; M276-N279 PolarHBondContact O-N 3.02Å; N279-S283 PolarHBondContact O-OG 3.02Å
280	L	33.5	Very low	35.7	Very low	102 Å²	102	91.8 Å²	91.8	53%	0.534	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-35	173.8	-69.6	162.5	0	0	0	112.5	M276	M276-L280 HydrophobicContact CB-CD1 4Å; M276-L280 HydrophobicContact CE-CD1 3.78Å; M276-L280 HydrophobicContact CG-CD1 4.03Å; M276-L280 WeakPolarHBondContact O-CB 3.5Å; M276-L280 PolarHBondContact O-N 3.28Å
281	F	32.9	Very low	35.3	Very low	43 Å²	43	89.5 Å²	89.5	19%	0.189	44%	0.436	C	S	.	.	S	Bend	trans	-91.8	-20.6	-170.4	-59.9	-110.5	0	0	0	113.6	M276 Y277 S283 I288 A291 I295	M276-F281 VanDerWaalsContact O-CD2 3.31Å; M276-F281 WeakPolarHBondContact O-CD2 3.5Å; Y277-F281 VanDerWaalsContact CA-CD2 3.45Å; Y277-F281 HydrophobicContact CD2-CD2 4.33Å; Y277-F281 HydrophobicContact CD2-CE2 4.43Å; Y277-F281 HydrophobicContact CD2-CG 4.41Å; Y277-F281 WeakPolarHBondContact O-CB 3.48Å; F281-S283 PolarHBondContact O-N 2.95Å; F281-I288 HydrophobicContact CD1-CG1 4.48Å; F281-A291 HydrophobicContact CE1-CB 3.84Å; F281-A291 HydrophobicContact CZ-CB 3.87Å; F281-I295 HydrophobicContact CZ-CD1 3.82Å
282	Y	32	Very low	34.9	Very low	174 Å²	174	92.4 Å²	92.4	68%	0.682	45%	0.448	S	S	*	.	S	Bend	trans	-71.3	-16.4	172.8	-92.5	-97.5	0	0	0	113.5	K278	K278-Y282 WeakPolarHBondContact O-CB 3.45Å; K278-Y282 VanDerWaalsContact O-CD2 3.24Å; K278-Y282 WeakPolarHBondContact O-CD2 3.46Å
283	S	30.9	Very low	34.7	Very low	74 Å²	74	93.4 Å²	93.4	52%	0.517	46%	0.457	S	S	.	.	S	Bend	trans	-95.4	-27.1	-168.2	-45.4	0	0	0	0	114.1	N279 F281	N279-S283 PolarHBondContact O-OG 3.02Å; F281-S283 PolarHBondContact O-N 2.95Å
284	H	28.4	Very low	34.2	Very low	99 Å²	99	94.9 Å²	94.9	46%	0.458	47%	0.467	S	S	.	.			trans	-153.6	110.3	179.5	-70	-70.2	0	0	0	113	K286 K287	H284-K286 PolarHBondContact O-N 3.18Å; H284-K287 HydrophobicContact CB-CB 4.34Å; H284-K287 HydrophobicContact CB-CD 3.93Å; H284-K287 HydrophobicContact CB-CG 4.06Å; H284-K287 PolarHBondContact CD2-NZ 3.35Å; H284-K287 VanDerWaalsContact CD2-NZ 3.34Å; H284-K287 PolarHBondContact O-N 2.94Å
285	P	31.2	Very low	33.6	Very low	104 Å²	104	94.1 Å²	94.1	68%	0.675	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-67.6	-21	176.7	26.5	-34	0	0	0	113.6	K287 I288	P285-K287 VanDerWaalsContact C-N 3.27Å; P285-K287 PolarHBondContact O-N 3.29Å; P285-I288 WeakPolarHBondContact O-CD1 3.26Å; P285-I288 WeakPolarHBondContact O-CG1 3.41Å
286	K	34.6	Very low	33.1	Very low	195 Å²	195	95.5 Å²	95.5	85%	0.848	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-80.3	3.5	178	-67.5	-171.4	175.7	-175.9	0	115	H284	H284-K286 PolarHBondContact O-N 3.18Å
287	K	33.9	Very low	32.8	Very low	106 Å²	106	98 Å²	98	46%	0.461	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-110.4	6.5	177.6	-67.4	179.5	179.6	163.3	0	113	H284 P285 A291	H284-K287 HydrophobicContact CB-CB 4.34Å; H284-K287 HydrophobicContact CB-CD 3.93Å; H284-K287 HydrophobicContact CB-CG 4.06Å; H284-K287 PolarHBondContact CD2-NZ 3.35Å; H284-K287 VanDerWaalsContact CD2-NZ 3.34Å; H284-K287 PolarHBondContact O-N 2.94Å; P285-K287 VanDerWaalsContact C-N 3.27Å; P285-K287 PolarHBondContact O-N 3.29Å; K287-A291 VanDerWaalsContact O-CB 3.25Å; K287-A291 WeakPolarHBondContact O-CB 3.5Å; K287-A291 PolarHBondContact O-N 3.45Å
288	I	29.8	Very low	32.3	Very low	60 Å²	60	99.8 Å²	99.8	31%	0.308	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-47.9	-179.7	-64.9	173	0	0	0	109.8	F281 P285 E290 A291 E292	F281-I288 HydrophobicContact CD1-CG1 4.48Å; P285-I288 WeakPolarHBondContact O-CD1 3.26Å; P285-I288 WeakPolarHBondContact O-CG1 3.41Å; I288-E290 PolarHBondContact O-N 3.47Å; I288-A291 CarbonylContact O-C 3.58Å; I288-A291 PolarHBondContact O-N 3.21Å; I288-E292 HydrophobicContact CG2-CG 4.24Å; I288-E292 WeakPolarHBondContact O-CB 3.29Å; I288-E292 WeakPolarHBondContact O-CG 3.26Å; I288-E292 PolarHBondContact O-N 2.82Å
289	D	32.2	Very low	31.7	Very low	116 Å²	116	98.7 Å²	98.7	62%	0.62	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-40.6	-177.5	-48.5	-37.5	0	0	0	112.6	T293	D289-T293 WeakPolarHBondContact O-CB 3.37Å; D289-T293 PolarHBondContact O-N 3.17Å; D289-T293 PolarHBondContact O-OG1 3.4Å
290	E	35	Very low	31.3	Very low	128 Å²	128	100.3 Å²	100.3	60%	0.598	51%	0.509	S	S	*	.	H	α-helix	trans	-63.9	-43.5	173.3	-67	-176.7	155.8	0	0	111.5	I288 T293 I294	I288-E290 PolarHBondContact O-N 3.47Å; E290-T293 WeakPolarHBondContact O-CB 3.42Å; E290-T293 PolarHBondContact O-N 3.09Å; E290-I294 VanDerWaalsContact O-CG1 3.29Å; E290-I294 WeakPolarHBondContact O-CG1 3.26Å; E290-I294 PolarHBondContact O-N 3.36Å
291	A	29.8	Very low	30.8	Very low	26 Å²	26	99.9 Å²	99.9	22%	0.215	51%	0.513	C	S	.	.	H	α-helix	trans	-70.8	-37.1	179.6	0	0	0	0	0	112.8	F281 K287 I288 T293 I294 I295	F281-A291 HydrophobicContact CE1-CB 3.84Å; F281-A291 HydrophobicContact CZ-CB 3.87Å; K287-A291 VanDerWaalsContact O-CB 3.25Å; K287-A291 WeakPolarHBondContact O-CB 3.5Å; K287-A291 PolarHBondContact O-N 3.45Å; I288-A291 CarbonylContact O-C 3.58Å; I288-A291 PolarHBondContact O-N 3.21Å; A291-T293 VanDerWaalsContact C-N 3.33Å; A291-I294 PolarHBondContact O-N 3.15Å; A291-I295 VanDerWaalsContact O-CB 3.26Å; A291-I295 WeakPolarHBondContact O-CB 3.26Å; A291-I295 VanDerWaalsContact O-CG1 3.22Å; A291-I295 WeakPolarHBondContact O-CG1 3.27Å; A291-I295 PolarHBondContact O-N 3.2Å
292	E	30.6	Very low	30.5	Very low	115 Å²	115	103.5 Å²	103.5	54%	0.537	54%	0.541	S	S	.	.	H	α-helix	trans	-67.4	-35	172.6	-74.6	-167	165.6	0	0	111.4	I288 I295 S296	I288-E292 HydrophobicContact CG2-CG 4.24Å; I288-E292 WeakPolarHBondContact O-CB 3.29Å; I288-E292 WeakPolarHBondContact O-CG 3.26Å; I288-E292 PolarHBondContact O-N 2.82Å; E292-I295 PolarHBondContact O-N 3.39Å; E292-S296 WeakPolarHBondContact O-CB 3.39Å; E292-S296 PolarHBondContact O-N 3.4Å; E292-S296 PolarHBondContact O-OG 3.32Å
293	T	35.7	Very low	30.1	Very low	80 Å²	80	103.6 Å²	103.6	49%	0.491	54%	0.544	S	S	.	.	H	α-helix	trans	-63.8	-48.9	171.9	-57.8	0	0	0	0	110.9	D289 E290 A291 I295 S296 N297	D289-T293 WeakPolarHBondContact O-CB 3.37Å; D289-T293 PolarHBondContact O-N 3.17Å; D289-T293 PolarHBondContact O-OG1 3.4Å; E290-T293 WeakPolarHBondContact O-CB 3.42Å; E290-T293 PolarHBondContact O-N 3.09Å; A291-T293 VanDerWaalsContact C-N 3.33Å; T293-I295 PolarHBondContact O-N 3.13Å; T293-S296 PolarHBondContact O-N 3.45Å; T293-N297 WeakPolarHBondContact O-CB 3.32Å; T293-N297 PolarHBondContact O-N 3.36Å; T293-N297 PolarHBondContact O-ND2 2.79Å
294	I	31.3	Very low	29.8	Very low	103 Å²	103	107.6 Å²	107.6	53%	0.528	56%	0.56	S	S	.	*	H	α-helix	trans	-61.3	-45.2	176	-67.8	162.6	0	0	0	110.9	E290 A291 N297 Y298	E290-I294 VanDerWaalsContact O-CG1 3.29Å; E290-I294 WeakPolarHBondContact O-CG1 3.26Å; E290-I294 PolarHBondContact O-N 3.36Å; A291-I294 PolarHBondContact O-N 3.15Å; I294-N297 PolarHBondContact O-N 3.22Å; I294-Y298 HydrophobicContact CG2-CD2 4.44Å; I294-Y298 HydrophobicContact CG2-CE2 4.38Å; I294-Y298 WeakPolarHBondContact O-CD2 3.4Å; I294-Y298 PolarHBondContact O-N 3.34Å
295	I	31.2	Very low	29.7	Very low	42 Å²	42	109.1 Å²	109.1	22%	0.215	58%	0.576	C	S	.	*	H	α-helix	trans	-69.2	-39.3	-178	-73.3	168.1	0	0	0	111.2	F281 A291 E292 T293 Y298 L299	F281-I295 HydrophobicContact CZ-CD1 3.82Å; A291-I295 VanDerWaalsContact O-CB 3.26Å; A291-I295 WeakPolarHBondContact O-CB 3.26Å; A291-I295 VanDerWaalsContact O-CG1 3.22Å; A291-I295 WeakPolarHBondContact O-CG1 3.27Å; A291-I295 PolarHBondContact O-N 3.2Å; E292-I295 PolarHBondContact O-N 3.39Å; T293-I295 PolarHBondContact O-N 3.13Å; I295-Y298 PolarHBondContact O-N 2.83Å; I295-L299 HydrophobicContact CG2-CD1 3.52Å; I295-L299 HydrophobicContact CG2-CG 4.24Å; I295-L299 VanDerWaalsContact O-CB 3.26Å; I295-L299 WeakPolarHBondContact O-CB 3.36Å; I295-L299 WeakPolarHBondContact O-CG 3.36Å; I295-L299 PolarHBondContact O-N 3.25Å
296	S	31.5	Very low	29.2	Very low	66 Å²	66	113.1 Å²	113.1	46%	0.462	58%	0.583	S	S	.	*	H	α-helix	trans	-65.6	-41.3	176.7	-61.4	0	0	0	0	112.2	E292 T293 Y298 L299 V300	E292-S296 WeakPolarHBondContact O-CB 3.39Å; E292-S296 PolarHBondContact O-N 3.4Å; E292-S296 PolarHBondContact O-OG 3.32Å; T293-S296 PolarHBondContact O-N 3.45Å; S296-Y298 PolarHBondContact O-N 2.79Å; S296-L299 PolarHBondContact O-N 2.88Å; S296-V300 PolarHBondContact O-N 3.43Å
297	N	30.1	Very low	28.6	Very low	116 Å²	116	108.6 Å²	108.6	62%	0.62	58%	0.575	S	S	*	*	H	α-helix	trans	-63.9	-24.4	177.6	-72	-15.7	0	0	0	113.4	T293 I294	T293-N297 WeakPolarHBondContact O-CB 3.32Å; T293-N297 PolarHBondContact O-N 3.36Å; T293-N297 PolarHBondContact O-ND2 2.79Å; I294-N297 PolarHBondContact O-N 3.22Å
298	Y	29.7	Very low	28.2	Very low	165 Å²	165	112.6 Å²	112.6	65%	0.647	60%	0.596	S	S	*	*	H	α-helix	trans	-102.5	-10.2	179.4	-75.6	-113.3	0	0	0	113.5	T256 I294 I295 S296	T256-Y298 HydrophobicContact CG2-CE1 3.8Å; I294-Y298 HydrophobicContact CG2-CD2 4.44Å; I294-Y298 HydrophobicContact CG2-CE2 4.38Å; I294-Y298 WeakPolarHBondContact O-CD2 3.4Å; I294-Y298 PolarHBondContact O-N 3.34Å; I295-Y298 PolarHBondContact O-N 2.83Å; S296-Y298 PolarHBondContact O-N 2.79Å
299	L	28.3	Very low	27.8	Very low	96 Å²	96	117.4 Å²	117.4	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-97.5	-17.2	179.3	-86.8	178.9	0	0	0	114.7	Y269 I295 S296 P301	Y269-L299 WeakPolarHBondContact OH-CD2 3.46Å; I295-L299 HydrophobicContact CG2-CD1 3.52Å; I295-L299 HydrophobicContact CG2-CG 4.24Å; I295-L299 VanDerWaalsContact O-CB 3.26Å; I295-L299 WeakPolarHBondContact O-CB 3.36Å; I295-L299 WeakPolarHBondContact O-CG 3.36Å; I295-L299 PolarHBondContact O-N 3.25Å; S296-L299 PolarHBondContact O-N 2.88Å; L299-P301 VanDerWaalsContact O-CD 3.29Å; L299-P301 WeakPolarHBondContact O-CD 3.31Å
300	V	25.4	Very low	27.4	Very low	96 Å²	96	118.6 Å²	118.6	58%	0.582	63%	0.632	S	S	*	*	S	Bend	trans	-88	109.3	172.2	179.9	0	0	0	0	108.5	S296	S296-V300 PolarHBondContact O-N 3.43Å
301	P	22.8	Very low	26.8	Very low	94 Å²	94	117.5 Å²	117.5	61%	0.61	64%	0.637	S	S	*	*			trans	-60.9	134.3	168.3	27	-33.2	0	0	0	107.9	L299 K303	L299-P301 VanDerWaalsContact O-CD 3.29Å; L299-P301 WeakPolarHBondContact O-CD 3.31Å; P301-K303 PolarHBondContact O-N 3.11Å
302	P	25.3	Very low	26.6	Very low	119 Å²	119	124 Å²	124	77%	0.773	66%	0.662	S	S	*	*			trans	-63.1	98.4	-170.5	23.3	-33.5	0	0	0	110.9	N304	P302-N304 PolarHBondContact O-N 3.15Å
303	K	24.2	Very low	26.3	Very low	175 Å²	175	125.8 Å²	125.8	76%	0.761	67%	0.67	S	S	*	*			trans	-77.5	113.8	169.6	-72.1	-177.9	177.7	179.7	0	107.6	P301	P301-K303 PolarHBondContact O-N 3.11Å
304	N	24	Very low	25.8	Very low	158 Å²	158	128.6 Å²	128.6	85%	0.845	69%	0.688	S	S	*	*			trans	63.4	74.2	169.2	-52.7	-22	0	0	0	115.8	P302	P302-N304 PolarHBondContact O-N 3.15Å
305	V	26.3	Very low	25.5	Very low	131 Å²	131	130 Å²	130	79%	0.794	70%	0.696	S	S	*	*			trans	-111.8	107.2	150.8	-176.9	0	0	0	0	108.1
306	K	22.3	Very low	25.3	Very low	189 Å²	189	137.1 Å²	137.1	82%	0.822	73%	0.728	S	S	*	*			trans	-78.9	137.8	171.1	-70.3	179.8	175.1	179.1	0	109.3
307	S	22	Very low	24.8	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	75%	0.746	S	S	*	*			trans	46	105.5	146.1	59.6	0	0	0	0	119.9
308	Q	24	Very low	24.6	Very low	190 Å²	190	142.6 Å²	142.6	89%	0.888	76%	0.756	S	S	*	*			trans	-172.7	93.6	135	-102.2	162.6	12.1	0	0	107
309	L	21.6	Very low	24.3	Very low	162 Å²	162	143.2 Å²	143.2	85%	0.848	77%	0.765	S	S	*	*				59	86.2	86.2	-74.9	169.3	0	0	0	114.5
310	V	23.9	Very low	24.1	Very low	140 Å²	140	145.5 Å²	145.5	85%	0.848	78%	0.782	S	S	*	*			trans	-138.1	121.8	143.2	-176.1	0	0	0	0	107
311	P	23.7	Very low	24	Very low	106 Å²	106	148.1 Å²	148.1	69%	0.688	79%	0.789	S	S	*	*			trans	-94.2	147.9	-177.9	35.6	-32.7	0	0	0	112.6
312	H	24.7	Very low	24.1	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.745	80%	0.797	S	S	*	*			trans	-160.9	105.6	138.7	-110.9	-73.9	0	0	0	111
313	E	24.3	Very low	24.1	Very low	153 Å²	153	152.1 Å²	152.1	72%	0.715	80%	0.797	S	S	*	*			trans	38.8	100.2	130.9	-59.1	172.1	161.6	0	0	119.2
314	T	26.2	Very low	24.2	Very low	139 Å²	139	149.1 Å²	149.1	85%	0.853	80%	0.795	S	S	*	*				179.9	144	92.7	28.2	0	0	0	0	111.4
315	D	23.3	Very low	24.2	Very low	133 Å²	133	148.7 Å²	148.7	71%	0.711	80%	0.799	S	S	*	*			trans	-57.6	140.4	-168.7	-56.6	-71.6	0	0	0	116
316	H	28	Very low	24.1	Very low	192 Å²	192	149 Å²	149	89%	0.889	80%	0.8	S	S	*	*				-164.5	111	115.1	-87.6	-44.7	0	0	0	110.9
317	L	21.8	Very low	24.2	Very low	159 Å²	159	146.1 Å²	146.1	83%	0.832	79%	0.794	S	S	*	*			trans	-76.7	128.5	177.7	-70.5	160.8	0	0	0	111.7
318	V	25.3	Very low	24.5	Very low	137 Å²	137	149.5 Å²	149.5	83%	0.83	80%	0.803	S	S	*	*			trans	-136.3	115.2	152.4	-178.4	0	0	0	0	108.7
319	Q	22.2	Very low	24.5	Very low	179 Å²	179	147.1 Å²	147.1	84%	0.836	80%	0.797	S	S	*	*			trans	-81.2	137.3	176.1	-63.3	168.7	-55.3	0	0	110.9
320	V	24.4	Very low	24.8	Very low	143 Å²	143	148.2 Å²	148.2	87%	0.867	80%	0.798	S	S	*	*			trans	-142.7	144.7	152.1	-171	0	0	0	0	108.7
321	E	24	Very low	24.8	Very low	152 Å²	152	149.9 Å²	149.9	71%	0.71	80%	0.801	S	S	*	*			trans	-84.3	160.2	-150.7	-58	179.5	142.3	0	0	117.4	F323	E321-F323 HydrophobicContact CB-CE2 4.33Å
322	P	24.2	Very low	24.8	Very low	122 Å²	122	149.9 Å²	149.9	79%	0.792	80%	0.803	S	S	*	*			trans	-92.1	143.3	174.1	36.3	-33.1	0	0	0	113.7
323	F	25.2	Very low	25	Very low	175 Å²	175	149.7 Å²	149.7	77%	0.768	80%	0.804	S	S	*	*			trans	-146.6	152	175	-82.4	-76.8	0	0	0	111.4	E321	E321-F323 HydrophobicContact CB-CE2 4.33Å
324	P	26.5	Very low	25	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	80%	0.802	S	S	*	*				-119.6	158	-67.9	30	-13.7	0	0	0	111.9
325	T	23.4	Very low	25.1	Very low	149 Å²	149	150 Å²	150	91%	0.914	81%	0.805	S	S	*	*			trans	-73.2	127.6	178.6	38.4	0	0	0	0	112.4
326	V	25	Very low	25.3	Very low	137 Å²	137	150.7 Å²	150.7	83%	0.83	80%	0.804	S	S	*	*			trans	-106.2	130	165.7	179.1	0	0	0	0	109.3
327	N	24.3	Very low	25.2	Very low	128 Å²	128	147.9 Å²	147.9	68%	0.684	80%	0.796	S	S	*	*			trans	-85.2	129.6	-166.6	-171.1	-17.3	0	0	0	111.9	N329	N327-N329 WeakPolarHBondContact OD1-CB 3.36Å; N327-N329 PolarHBondContact OD1-N 3.16Å
328	L	27.9	Very low	25.6	Very low	170 Å²	170	147.8 Å²	147.8	89%	0.89	80%	0.796	S	S	*	*			trans	-104.3	50	178.1	-85.4	165.5	0	0	0	112.1
329	N	25.5	Very low	25.6	Very low	141 Å²	141	150.1 Å²	150.1	75%	0.754	80%	0.798	S	S	*	*			trans	-112.5	62.1	170.9	-80.9	-7.4	0	0	0	111.7	N327	N327-N329 WeakPolarHBondContact OD1-CB 3.36Å; N327-N329 PolarHBondContact OD1-N 3.16Å
330	Q	26.7	Very low	25.9	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.864	79%	0.794	S	S	*	*			trans	-144.5	147.7	161.6	-70.6	-167.5	-21.6	0	0	109.3
331	L	24.7	Very low	25.9	Very low	175 Å²	175	147.2 Å²	147.2	92%	0.916	79%	0.792	S	S	*	*			trans	86	54	-175.3	-54.6	167.4	0	0	0	116.8
332	S	22.9	Very low	26.1	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	80%	0.801	S	S	*	*				-75.7	-176.1	128.5	54	0	0	0	0	110.3
333	M	28.2	Very low	26.1	Very low	157 Å²	157	147.8 Å²	147.8	77%	0.773	80%	0.797	S	S	*	*			trans	85.1	88.1	-163	-51.6	-61.2	-68.2	0	0	111.4
334	L	25	Very low	26.3	Very low	125 Å²	125	145.7 Å²	145.7	65%	0.654	80%	0.803	S	S	*	*				65.7	107.7	78.1	-66	171.3	0	0	0	112.8
335	D	29	Very low	26.1	Very low	174 Å²	174	145.6 Å²	145.6	93%	0.93	80%	0.796	S	S	*	*				-151.3	127.9	123.5	-105.2	-23.6	0	0	0	108.8
336	E	26.7	Very low	26.5	Very low	148 Å²	148	146.6 Å²	146.6	69%	0.692	79%	0.79	S	S	*	*			trans	-97.4	180	-176.6	-63	178.9	139.3	0	0	111
337	N	26.9	Very low	26.6	Very low	132 Å²	132	146.8 Å²	146.8	71%	0.706	78%	0.782	S	S	*	*			trans	73.9	99.3	162.8	-48.2	-47.7	0	0	0	117.2
338	N	28.9	Very low	26.7	Very low	157 Å²	157	147.2 Å²	147.2	84%	0.84	78%	0.784	S	S	*	*				-168.1	126.8	90.4	-95.5	-38.3	0	0	0	113.2
339	Q	25.9	Very low	26.6	Very low	187 Å²	187	146 Å²	146	87%	0.874	78%	0.779	S	S	*	*			trans	-79.5	138.2	162.8	-65.5	165.7	-28.4	0	0	109.1
340	S	29.1	Very low	26.6	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	78%	0.778	S	S	*	*			trans	-154.2	108.2	150.3	-35	0	0	0	0	111.3
341	N	24.8	Very low	26.7	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	77%	0.772	S	S	*	*			trans	21.8	124.6	139.4	-53.8	-20.6	0	0	0	118.9
342	V	28.2	Very low	26.6	Very low	149 Å²	149	139.1 Å²	139.1	90%	0.903	76%	0.761	S	S	*	*				-146.8	134.8	96.9	171.7	0	0	0	0	109
343	L	23.4	Very low	26.7	Very low	136 Å²	136	140.9 Å²	140.9	71%	0.712	76%	0.758	S	S	*	*			trans	-104.8	141.9	-179.7	-163	87.8	0	0	0	109.8
344	C	28.8	Very low	26.4	Very low	132 Å²	132	140.6 Å²	140.6	89%	0.892	76%	0.759	S	S	*	*			trans	-154.7	122.8	148.2	-109.7	0	0	0	0	111.4
345	N	23.8	Very low	26.3	Very low	110 Å²	110	141 Å²	141	59%	0.588	77%	0.767	S	S	*	*			trans	-94.4	158.3	175.8	-69.3	-36.3	0	0	0	110.3
346	H	30.8	Very low	26	Very low	169 Å²	169	138.5 Å²	138.5	78%	0.782	76%	0.758	S	S	*	*				-174.4	110.5	121.2	-86.3	-58.6	0	0	0	106.1
347	Q	26.4	Very low	25.7	Very low	141 Å²	141	136.4 Å²	136.4	66%	0.659	76%	0.759	S	S	*	*				61.6	102.8	78.9	-71.7	-179.9	-38.8	0	0	113.5
348	N	27.7	Very low	25.4	Very low	137 Å²	137	139.6 Å²	139.6	73%	0.733	76%	0.763	S	S	*	*				-176.9	126.9	101.7	-86.8	-31.1	0	0	0	112.2
349	N	25.6	Very low	25	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	76%	0.763	S	S	*	*				40.6	139.3	129.8	-59.4	-5.7	0	0	0	120.3
350	S	25.7	Very low	24.8	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	76%	0.755	S	S	*	*			cis	-175.9	171.9	5.3	39.9	0	0	0	0	112.1
351	V	27.7	Very low	24.5	Very low	123 Å²	123	138.8 Å²	138.8	75%	0.745	76%	0.759	S	S	*	*			trans	89.9	94	162.7	-165.4	0	0	0	0	116.8
352	N	23.6	Very low	24.4	Very low	129 Å²	129	138.8 Å²	138.8	69%	0.69	76%	0.758	S	S	*	*				39.5	141.2	124	-63.1	25.2	0	0	0	120.1
353	E	23.8	Very low	24.2	Very low	143 Å²	143	137.7 Å²	137.7	67%	0.668	75%	0.747	S	S	*	*			cis	-159.2	157.2	22.7	-126.4	145.8	-122.5	0	0	111.7
354	N	23.5	Very low	24.2	Very low	150 Å²	150	139.2 Å²	139.2	80%	0.802	75%	0.748	S	S	*	*			trans	60.4	72.9	162.8	-58.7	-26.4	0	0	0	119.4
355	V	21.8	Very low	23.9	Very low	135 Å²	135	139.4 Å²	139.4	82%	0.818	74%	0.74	S	S	*	*			trans	-115.1	110.6	155.5	178.9	0	0	0	0	109.4	S357	V355-S357 PolarHBondContact O-N 3.41Å
356	V	22.9	Very low	24	Very low	121 Å²	121	139.4 Å²	139.4	73%	0.733	75%	0.749	S	S	*	*			trans	-73.6	107.5	170.8	175.5	0	0	0	0	108.5	Y358	V356-Y358 HydrophobicContact CG1-CD2 4.27Å; V356-Y358 HydrophobicContact CG1-CE2 4Å; V356-Y358 PolarHBondContact O-N 3.48Å
357	S	20.1	Very low	23.6	Very low	103 Å²	103	141.1 Å²	141.1	72%	0.72	75%	0.754	S	S	*	*			trans	-72.3	105.7	177.9	52.7	0	0	0	0	111.5	V355	V355-S357 PolarHBondContact O-N 3.41Å
358	Y	22	Very low	23.5	Very low	199 Å²	199	142 Å²	142	78%	0.78	75%	0.753	S	S	*	*			trans	-87.9	103.3	158.6	-82.8	-80.6	0	0	0	109.7	V356 L360	V356-Y358 HydrophobicContact CG1-CD2 4.27Å; V356-Y358 HydrophobicContact CG1-CE2 4Å; V356-Y358 PolarHBondContact O-N 3.48Å; Y358-L360 PolarHBondContact O-N 2.93Å
359	E	19.7	Very low	23.4	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	75%	0.754	S	S	*	*			trans	-66.7	96.5	162.8	-67	-167.9	147.2	0	0	109.5
360	L	22.5	Very low	23.4	Very low	133 Å²	133	143.6 Å²	143.6	70%	0.696	75%	0.747	S	S	*	*			trans	-109.9	95	164	-84.7	169.6	0	0	0	109.7	Y358 L362	Y358-L360 PolarHBondContact O-N 2.93Å; L360-L362 HydrophobicContact CB-CD1 4.31Å; L360-L362 HydrophobicContact CB-CG 4.36Å; L360-L362 PolarHBondContact O-N 2.98Å
361	S	21.1	Very low	23.4	Very low	120 Å²	120	145.5 Å²	145.5	84%	0.839	75%	0.749	S	S	*	*			trans	-67.6	63.3	172.6	40.9	0	0	0	0	111.9	N363	S361-N363 PolarHBondContact O-N 3.39Å
362	L	24	Very low	23.3	Very low	152 Å²	152	147.9 Å²	147.9	80%	0.796	75%	0.75	S	S	*	*			trans	-78.3	70.3	178.8	-74.8	168.9	0	0	0	112.2	L360	L360-L362 HydrophobicContact CB-CD1 4.31Å; L360-L362 HydrophobicContact CB-CG 4.36Å; L360-L362 PolarHBondContact O-N 2.98Å
363	N	23.2	Very low	23.4	Very low	127 Å²	127	150.3 Å²	150.3	68%	0.679	75%	0.751	S	S	*	*			trans	25.8	98.6	145.3	-140.3	-2	0	0	0	117.7	S361 N365	S361-N363 PolarHBondContact O-N 3.39Å; N363-N365 PolarHBondContact O-N 2.99Å
364	K	24.1	Very low	23.6	Very low	168 Å²	168	153.1 Å²	153.1	73%	0.73	76%	0.76	S	S	*	*	S	Bend	trans	-48.8	124	149.2	-68.7	169.2	178.2	174.5	0	107.8
365	N	22.9	Very low	23.8	Very low	135 Å²	135	157.1 Å²	157.1	72%	0.722	76%	0.764	S	S	*	*			trans	91.6	95.9	-174.7	-49.1	-64.3	0	0	0	116.3	N363	N363-N365 PolarHBondContact O-N 2.99Å
366	S	25.2	Very low	23.9	Very low	111 Å²	111	157.1 Å²	157.1	78%	0.776	77%	0.767	S	S	*	*			trans	-129.7	33.5	158.2	55.4	0	0	0	0	113.2	Y368	S366-Y368 VanDerWaalsContact C-N 3.32Å; S366-Y368 PolarHBondContact O-N 3.19Å
367	F	22.9	Very low	24.1	Very low	205 Å²	205	159.8 Å²	159.8	90%	0.899	77%	0.774	S	S	*	*			trans	-81.1	69.6	173.2	-115.7	-79.3	0	0	0	112
368	Y	24	Very low	24.6	Very low	160 Å²	160	164.4 Å²	164.4	63%	0.627	78%	0.781	S	S	*	*			trans	-152.3	146.9	178	-71.3	-79.2	0	0	0	108.1	S366	S366-Y368 VanDerWaalsContact C-N 3.32Å; S366-Y368 PolarHBondContact O-N 3.19Å
369	Y	25.3	Very low	24.8	Very low	195 Å²	195	160.3 Å²	160.3	77%	0.765	78%	0.779	S	S	*	*			cis	-144.7	175.9	14.2	-65.6	-81.8	0	0	0	107.9
370	L	25.4	Very low	25.1	Very low	121 Å²	121	161.1 Å²	161.1	63%	0.634	78%	0.775	S	S	*	*			cis	-155.4	132.6	-12	-125.9	163.9	0	0	0	106.7
371	N	25.1	Very low	25.2	Very low	142 Å²	142	164.2 Å²	164.2	76%	0.759	78%	0.783	S	S	*	*			trans	-106.2	95.2	166.4	-154.2	-10.5	0	0	0	108.6	Y373	N371-Y373 PolarHBondContact O-N 3.31Å
372	K	26.6	Very low	25.5	Very low	174 Å²	174	161.5 Å²	161.5	76%	0.757	77%	0.768	S	S	*	*			trans	-63.7	-4.5	-168.8	-166.9	170.9	179	179	0	114.3
373	Y	26	Very low	25.5	Very low	180 Å²	180	160.3 Å²	160.3	71%	0.706	77%	0.767	S	S	*	*	S	Bend	trans	-123.7	112.7	-178.9	-61.9	-81.7	0	0	0	112.1	N371	N371-Y373 PolarHBondContact O-N 3.31Å
374	K	28.3	Very low	25.7	Very low	201 Å²	201	162.5 Å²	162.5	87%	0.874	77%	0.767	S	S	*	*	S	Bend	trans	87.6	96.9	165.5	-53.4	-175.4	-179.9	-174.8	0	118.1
375	R	26.4	Very low	25.8	Very low	235 Å²	235	163.1 Å²	163.1	89%	0.887	77%	0.772	S	S	*	*			trans	67.3	116.6	158.7	-62.5	-173.9	177.8	-171.3	-1.1	117.5	M377	R375-M377 PolarHBondContact O-N 2.83Å
376	P	25.3	Very low	26.1	Very low	135 Å²	135	162.3 Å²	162.3	88%	0.877	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-70.1	127	168.2	30	-32.6	0	0	0	110.4
377	M	27	Very low	26.1	Very low	177 Å²	177	165.7 Å²	165.7	87%	0.872	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-80.1	135.9	165.4	-81	-74.2	-175.5	0	0	109.1	R375	R375-M377 PolarHBondContact O-N 2.83Å
378	K	29.8	Very low	26.4	Very low	199 Å²	199	162.8 Å²	162.8	87%	0.865	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-62.8	139.3	175.4	-72.8	-174.3	174.8	-174.9	0	110.4
379	P	26.9	Very low	26.6	Very low	113 Å²	113	162.8 Å²	162.8	73%	0.734	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.2	133.8	176	28.2	-34	0	0	0	110.7
380	Y	24.7	Very low	26.5	Very low	200 Å²	200	158.2 Å²	158.2	78%	0.784	78%	0.777	S	S	*	*			trans	-99	109.3	173	-176.4	-100.3	0	0	0	108.8	A382	Y380-A382 HydrophobicContact CD1-CB 4.27Å; Y380-A382 HydrophobicContact CE1-CB 4.05Å; Y380-A382 PolarHBondContact O-N 3.27Å
381	K	25.7	Very low	26.5	Very low	199 Å²	199	160 Å²	160	87%	0.865	78%	0.782	S	S	*	*			trans	-74.1	118.3	172.6	-80.3	-175.3	174.6	-178.5	0	109.2
382	A	26.1	Very low	26.5	Very low	62 Å²	62	160.9 Å²	160.9	51%	0.512	78%	0.782	S	S	.	*			trans	-121.7	108.7	163.9	0	0	0	0	0	108.5	Y380 Y384	Y380-A382 HydrophobicContact CD1-CB 4.27Å; Y380-A382 HydrophobicContact CE1-CB 4.05Å; Y380-A382 PolarHBondContact O-N 3.27Å; A382-Y384 HydrophobicContact CB-CE2 4.19Å
383	T	25.5	Very low	26.4	Very low	128 Å²	128	157.4 Å²	157.4	79%	0.785	78%	0.776	S	S	*	*			trans	-94.1	114.5	176.2	45	0	0	0	0	109.5
384	Y	27.5	Very low	26.2	Very low	172 Å²	172	154.1 Å²	154.1	68%	0.675	78%	0.779	S	S	*	*			trans	-110.6	133.9	166.6	-73.2	-84.9	0	0	0	109.4	A382	A382-Y384 HydrophobicContact CB-CE2 4.19Å
385	H	25.8	Very low	26.1	Very low	182 Å²	182	152.9 Å²	152.9	84%	0.843	77%	0.774	S	S	*	*			trans	-95	119.6	165	-81.2	-95	0	0	0	107.6
386	S	28.2	Very low	26	Very low	117 Å²	117	146.7 Å²	146.7	82%	0.818	76%	0.764	S	S	*	*			trans	-106	109.3	165.9	-66.7	0	0	0	0	107.9
387	K	26.6	Very low	25.9	Very low	183 Å²	183	146.3 Å²	146.3	80%	0.796	76%	0.755	S	S	*	*			trans	-107.9	154.1	149.8	-81.4	-169.9	172.8	-173.5	0	107.3
388	D	27.4	Very low	25.7	Very low	143 Å²	143	145.9 Å²	145.9	77%	0.765	74%	0.743	S	S	*	*			trans	79.8	138.9	161.8	-45.3	-37.3	0	0	0	118.7
389	I	28.2	Very low	25.4	Very low	160 Å²	160	144.1 Å²	144.1	82%	0.821	74%	0.743	S	S	*	*			trans	80.6	82.4	165.3	-52.6	150.4	0	0	0	115.6
390	S	24.2	Very low	25.5	Very low	100 Å²	100	145.5 Å²	145.5	70%	0.699	74%	0.744	S	S	*	*			trans	-48	135.9	139	48.3	0	0	0	0	112.1
391	E	26.1	Very low	25.5	Very low	158 Å²	158	145.4 Å²	145.4	74%	0.738	75%	0.748	S	S	*	*				169.2	126.3	119.3	-94.4	-178.5	167.6	0	0	112.2
392	Q	24.4	Very low	25.4	Very low	160 Å²	160	143 Å²	143	75%	0.748	74%	0.744	S	S	*	*			trans	59	167.8	146.9	-54.9	-174.4	18.9	0	0	120.2
393	T	23.6	Very low	25.4	Very low	102 Å²	102	145.5 Å²	145.5	63%	0.626	76%	0.756	S	S	*	*			trans	77.1	119	172.9	73.8	0	0	0	0	118.3	F395	T393-F395 WeakPolarHBondContact O-CD2 3.42Å
394	S	23.4	Very low	25.6	Very low	111 Å²	111	146.3 Å²	146.3	78%	0.776	75%	0.754	S	S	*	*			trans	-39.7	130.6	155.6	50	0	0	0	0	114.4
395	F	24.9	Very low	25.4	Very low	175 Å²	175	145.2 Å²	145.2	77%	0.768	76%	0.759	S	S	*	*			trans	-109.3	115.8	166.1	-79.3	-78.9	0	0	0	111.4	T393	T393-F395 WeakPolarHBondContact O-CD2 3.42Å
396	P	24	Very low	25.5	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	76%	0.757	S	S	*	*			trans	-86.2	166.5	-169	34.2	-36.8	0	0	0	114.1
397	N	23.1	Very low	25.4	Very low	127 Å²	127	143.7 Å²	143.7	68%	0.679	75%	0.753	S	S	*	*	S	Bend	trans	-65.6	128.8	172.7	-119.8	-49.1	0	0	0	112.1
398	R	24.2	Very low	25.6	Very low	168 Å²	168	142.7 Å²	142.7	63%	0.634	76%	0.756	S	S	*	*	S	Bend	trans	63.3	145.4	164.8	-58	-179.9	175.1	174.9	-0.1	116.9	E432	R398-E432 IonicContact CZ-OE1 3.85Å; R398-E432 IonicContact NH2-OE1 3.69Å; R398-E432 PolarHBondContact NH2-OE1 2.92Å; R398-E432 IonicContact NH2-OE2 2.66Å; R398-E432 PolarHBondContact NH2-OE2 3.12Å
399	N	23.8	Very low	25.6	Very low	161 Å²	161	143.7 Å²	143.7	86%	0.861	76%	0.756	S	S	*	*			trans	81.2	57	172.9	-49	-23.6	0	0	0	118.6
400	L	27.2	Very low	25.6	Very low	142 Å²	142	142.6 Å²	142.6	74%	0.743	75%	0.752	S	S	*	*			trans	-139.9	94.1	161.5	-93.6	164.6	0	0	0	110.7
401	F	25.2	Very low	25.8	Very low	199 Å²	199	145.5 Å²	145.5	87%	0.873	76%	0.759	S	S	*	*			trans	168.7	64	144.7	-89.7	-59.4	0	0	0	109.9
402	N	24.8	Very low	26.1	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	75%	0.751	S	S	*	*			trans	-71.2	127.7	148.4	-77.5	-12.4	0	0	0	106.4	I404	N402-I404 PolarHBondContact O-N 3.32Å; N402-I404 VanDerWaalsContact O-N 3.13Å
403	P	25.3	Very low	26.6	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	76%	0.758	S	S	*	*			trans	-67.5	112.9	170.8	-8.7	24.3	0	0	0	107.5	D405	P403-D405 PolarHBondContact O-N 2.93Å
404	I	29.3	Very low	27.2	Very low	145 Å²	145	138.8 Å²	138.8	74%	0.744	75%	0.754	S	S	*	*			trans	-80.5	105.5	164.1	-64	176.4	0	0	0	105.5	N402 N406	N402-I404 PolarHBondContact O-N 3.32Å; N402-I404 VanDerWaalsContact O-N 3.13Å; I404-N406 PolarHBondContact O-N 2.89Å
405	D	23.5	Very low	27.7	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	74%	0.741	S	S	*	*			trans	-59.3	116.4	163.9	-71.3	-47.9	0	0	0	108.1	P403	P403-D405 PolarHBondContact O-N 2.93Å
406	N	28.9	Very low	28.2	Very low	147 Å²	147	137.3 Å²	137.3	79%	0.786	74%	0.74	S	S	*	*			trans	-151.6	118.9	152.5	-98.4	-33.9	0	0	0	109.7	I404	I404-N406 PolarHBondContact O-N 2.89Å
407	T	26.2	Very low	28.6	Very low	119 Å²	119	140.5 Å²	140.5	73%	0.73	74%	0.744	S	S	*	*			trans	-48.6	129.4	175.9	47.7	0	0	0	0	113
408	N	30.2	Very low	28.9	Very low	162 Å²	162	141.6 Å²	141.6	87%	0.866	74%	0.744	S	S	*	*				-150.6	135.1	118.1	-97.1	-27.9	0	0	0	109.9
409	E	27.3	Very low	29.1	Very low	165 Å²	165	136.6 Å²	136.6	77%	0.771	73%	0.733	S	S	*	*			trans	-80	-176.5	-173.3	-60.5	-174.7	118.1	0	0	111.8
410	N	27.7	Very low	29.6	Very low	137 Å²	137	131.8 Å²	131.8	73%	0.733	71%	0.712	S	S	*	*			trans	74.2	71.6	165.3	-46.2	-39	0	0	0	115.5
411	N	29.1	Very low	29.8	Very low	160 Å²	160	132.3 Å²	132.3	86%	0.856	71%	0.708	S	S	*	*	S	Bend		-172.7	153.9	116	-92.9	-38.7	0	0	0	114.5
412	S	32.7	Very low	30.1	Very low	81 Å²	81	127.3 Å²	127.3	57%	0.566	69%	0.69	S	S	*	*			trans	63.6	83.7	156.9	-60.7	0	0	0	0	118.7	G414 V415	S412-G414 PolarHBondContact O-N 2.78Å; S412-V415 PolarHBondContact O-N 3.05Å
413	T	34.7	Very low	30.6	Very low	145 Å²	145	123.8 Å²	123.8	89%	0.89	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-1.8	170.5	46.2	0	0	0	0	116.5
414	G	35.6	Very low	31.1	Very low	53 Å²	53	122.2 Å²	122.2	55%	0.546	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86	-32.5	176	0	0	0	0	0	115.5	S412 K416	S412-G414 PolarHBondContact O-N 2.78Å; G414-K416 PolarHBondContact O-N 3.41Å
415	V	35.2	Very low	31.7	Very low	82 Å²	82	120.7 Å²	120.7	50%	0.497	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-32.4	-167.9	-177.9	0	0	0	0	112.5	S412 K417 Q418 T419	S412-V415 PolarHBondContact O-N 3.05Å; V415-K417 PolarHBondContact O-N 3.48Å; V415-K417 VanDerWaalsContact O-N 3.08Å; V415-Q418 PolarHBondContact O-N 3.49Å; V415-Q418 VanDerWaalsContact O-N 3.1Å; V415-T419 HydrophobicContact CG1-CG2 3.95Å; V415-T419 PolarHBondContact O-N 3.25Å; V415-T419 PolarHBondContact O-OG1 3.16Å
416	K	34.4	Very low	32.8	Very low	173 Å²	173	120.5 Å²	120.5	75%	0.752	65%	0.646	S	S	*	*	H	α-helix	trans	-62.2	-18.3	-176.6	-61.8	-175	-180	-177.6	0	114.3	G414	G414-K416 PolarHBondContact O-N 3.41Å
417	K	32.6	Very low	33.8	Very low	173 Å²	173	122.4 Å²	122.4	75%	0.752	64%	0.642	S	S	*	*	H	α-helix	trans	-90.7	-18.8	176.3	-81.2	-178.4	177.5	173.6	0	114.6	V415 S420	V415-K417 PolarHBondContact O-N 3.48Å; V415-K417 VanDerWaalsContact O-N 3.08Å; K417-S420 PolarHBondContact O-OG 3.17Å
418	Q	30.1	Very low	35.8	Very low	149 Å²	149	122 Å²	122	70%	0.696	63%	0.627	S	S	*	*	H	α-helix	trans	-92.9	-39.4	178.2	-71.8	179.7	-11.2	0	0	111.5	V415 S420 K421 L422	V415-Q418 PolarHBondContact O-N 3.49Å; V415-Q418 VanDerWaalsContact O-N 3.1Å; Q418-S420 VanDerWaalsContact C-N 3.31Å; Q418-S420 PolarHBondContact O-N 3.41Å; Q418-K421 PolarHBondContact O-N 2.88Å; Q418-L422 PolarHBondContact O-N 3.39Å; Q418-L422 VanDerWaalsContact O-N 3.15Å
419	T	28.5	Very low	38.2	Very low	63 Å²	63	116.5 Å²	116.5	39%	0.387	60%	0.598	S	S	.	*	H	α-helix	trans	-58.5	-41.1	175.1	51.4	0	0	0	0	112	V415 K421 L422 I423	V415-T419 HydrophobicContact CG1-CG2 3.95Å; V415-T419 PolarHBondContact O-N 3.25Å; V415-T419 PolarHBondContact O-OG1 3.16Å; T419-K421 VanDerWaalsContact C-N 3.32Å; T419-K421 PolarHBondContact O-N 3.08Å; T419-L422 PolarHBondContact O-N 3.37Å; T419-I423 WeakPolarHBondContact O-CB 3.42Å; T419-I423 WeakPolarHBondContact O-CD1 3.06Å; T419-I423 WeakPolarHBondContact O-CG1 3.25Å; T419-I423 PolarHBondContact O-N 3.48Å
420	S	32.4	Very low	40.9	Very low	60 Å²	60	113 Å²	113	42%	0.42	58%	0.584	S	S	.	*	H	α-helix	trans	-59	-38.3	177.7	62.2	0	0	0	0	113.5	K417 Q418 T424	K417-S420 PolarHBondContact O-OG 3.17Å; Q418-S420 VanDerWaalsContact C-N 3.31Å; Q418-S420 PolarHBondContact O-N 3.41Å; S420-T424 WeakPolarHBondContact O-CG2 3.27Å; S420-T424 PolarHBondContact O-N 2.82Å; S420-T424 VanDerWaalsContact O-N 3.13Å; S420-T424 PolarHBondContact O-OG1 2.84Å
421	K	33.3	Very low	43.7	Very low	153 Å²	153	106.6 Å²	106.6	67%	0.665	55%	0.55	S	S	*	.	H	α-helix	trans	-72.6	-39	175.4	-80.2	-180	176	175.7	0	113	Q418 T419 T424 H425	Q418-K421 PolarHBondContact O-N 2.88Å; T419-K421 VanDerWaalsContact C-N 3.32Å; T419-K421 PolarHBondContact O-N 3.08Å; K421-T424 WeakPolarHBondContact CA-OG1 3.42Å; K421-T424 PolarHBondContact O-N 2.86Å; K421-T424 PolarHBondContact O-OG1 3.06Å; K421-H425 PolarHBondContact O-CD2 3.01Å
422	L	30.7	Very low	46.4	Very low	94 Å²	94	104.3 Å²	104.3	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-64.3	-45.3	174.1	-118.9	79	0	0	0	111.2	Q418 T419 T424 H425 L426	Q418-L422 PolarHBondContact O-N 3.39Å; Q418-L422 VanDerWaalsContact O-N 3.15Å; T419-L422 PolarHBondContact O-N 3.37Å; L422-T424 VanDerWaalsContact C-N 3.28Å; L422-T424 PolarHBondContact O-N 3.42Å; L422-H425 PolarHBondContact O-N 3.23Å; L422-L426 PolarHBondContact O-N 2.82Å
423	I	34.3	Very low	48.7	Very low	75 Å²	75	105.8 Å²	105.8	39%	0.385	53%	0.528	S	S	.	.	H	α-helix	trans	-58.1	-38.4	176.9	-69.1	164.5	0	0	0	110.9	T419 H425 L426 R427	T419-I423 WeakPolarHBondContact O-CB 3.42Å; T419-I423 WeakPolarHBondContact O-CD1 3.06Å; T419-I423 WeakPolarHBondContact O-CG1 3.25Å; T419-I423 PolarHBondContact O-N 3.48Å; I423-H425 VanDerWaalsContact C-N 3.25Å; I423-H425 PolarHBondContact O-N 2.92Å; I423-L426 PolarHBondContact O-N 3.34Å; I423-R427 HydrophobicContact CG2-CG 4Å; I423-R427 VanDerWaalsContact O-CB 3.3Å; I423-R427 WeakPolarHBondContact O-CB 3.24Å; I423-R427 WeakPolarHBondContact O-CG 3.49Å; I423-R427 PolarHBondContact O-N 3.33Å
424	T	37.4	Very low	51.2	Low	82 Å²	82	100 Å²	100	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-21.3	176.1	49.8	0	0	0	0	115.1	S420 K421 L422	S420-T424 WeakPolarHBondContact O-CG2 3.27Å; S420-T424 PolarHBondContact O-N 2.82Å; S420-T424 VanDerWaalsContact O-N 3.13Å; S420-T424 PolarHBondContact O-OG1 2.84Å; K421-T424 WeakPolarHBondContact CA-OG1 3.42Å; K421-T424 PolarHBondContact O-N 2.86Å; K421-T424 PolarHBondContact O-OG1 3.06Å; L422-T424 VanDerWaalsContact C-N 3.28Å; L422-T424 PolarHBondContact O-N 3.42Å
425	H	41.1	Very low	53.5	Low	112 Å²	112	99.2 Å²	99.2	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-92.3	-21	176.5	-77.9	-60.6	0	0	0	113.7	K421 L422 I423 R428	K421-H425 PolarHBondContact O-CD2 3.01Å; L422-H425 PolarHBondContact O-N 3.23Å; I423-H425 VanDerWaalsContact C-N 3.25Å; I423-H425 PolarHBondContact O-N 2.92Å; H425-R428 PolarHBondContact O-NE 3.15Å; H425-R428 PolarHBondContact O-NH2 2.96Å; H425-R428 VanDerWaalsContact O-NH2 3.1Å
426	L	45.8	Very low	55.7	Low	145 Å²	145	101.3 Å²	101.3	76%	0.759	49%	0.487	S	S	*	.	H	α-helix	trans	-86.3	-30.7	171.2	-68.3	163.6	0	0	0	112	L422 I423 R428	L422-L426 PolarHBondContact O-N 2.82Å; I423-L426 PolarHBondContact O-N 3.34Å; L426-R428 PolarHBondContact O-N 3.49Å
427	R	50.7	Low	58	Low	187 Å²	187	97.7 Å²	97.7	71%	0.706	48%	0.475	S	S	*	.	S	Bend	trans	-74.4	47.1	167.5	-72.3	-176.9	170.7	162.2	-4.1	112.7	I423	I423-R427 HydrophobicContact CG2-CG 4Å; I423-R427 VanDerWaalsContact O-CB 3.3Å; I423-R427 WeakPolarHBondContact O-CB 3.24Å; I423-R427 WeakPolarHBondContact O-CG 3.49Å; I423-R427 PolarHBondContact O-N 3.33Å
428	R	67.5	Low	60.5	Low	110 Å²	110	91.5 Å²	91.5	42%	0.415	45%	0.448	S	S	.	.			trans	-117.2	113	175.3	-76	-172.8	-65.9	-179	-2.2	110.1	H425 L426 I430 I437 F438	H425-R428 PolarHBondContact O-NE 3.15Å; H425-R428 PolarHBondContact O-NH2 2.96Å; H425-R428 VanDerWaalsContact O-NH2 3.1Å; L426-R428 PolarHBondContact O-N 3.49Å; R428-I430 PolarHBondContact O-N 3.23Å; R428-I437 HydrophobicContact CB-CG2 3.66Å; R428-I437 HydrophobicContact CG-CG2 4.28Å; R428-F438 CarbonylContact C-O 3.33Å; R428-F438 WeakPolarHBondContact CA-O 3.34Å
429	D	81.6	Confident	63	Low	47 Å²	47	94.6 Å²	94.6	25%	0.251	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	117.9	-174.4	-54.3	-91.6	0	0	0	111	F438 N440 C441 L444	D429-F438 HydrophobicContact CB-CB 4.46Å; D429-F438 PolarHBondContact N-O 3.34Å; D429-F438 VanDerWaalsContact N-O 3.12Å; D429-F438 PolarHBondContact O-N 2.8Å; D429-N440 WeakPolarHBondContact OD2-CA 3.41Å; D429-C441 VanDerWaalsContact CG-CA 3.4Å; D429-C441 WeakPolarHBondContact OD1-CA 3.17Å; D429-C441 VanDerWaalsContact OD1-CB 3.32Å; D429-C441 WeakPolarHBondContact OD1-CB 3.39Å; D429-C441 WeakPolarHBondContact OD2-CA 3.06Å; D429-C441 PolarHBondContact OD2-N 3.09Å; D429-L444 HydrophobicContact CB-CB 3.7Å; D429-L444 HydrophobicContact CB-CD2 3.66Å; D429-L444 HydrophobicContact CB-CG 4.28Å
430	I	84	Confident	65.5	Low	93 Å²	93	95.9 Å²	95.9	48%	0.477	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.6	-176.2	-51.7	-176	0	0	0	110.2	R428 E432 I437 L444	R428-I430 PolarHBondContact O-N 3.23Å; I430-E432 PolarHBondContact O-N 3.36Å; I430-I437 HydrophobicContact CG1-CG1 4.25Å; I430-I437 HydrophobicContact CG1-CG2 4.48Å; I430-L444 WeakPolarHBondContact O-CD2 3.41Å
431	C	86	Confident	68	Low	1 Å²	1	96.5 Å²	96.5	1%	0.007	46%	0.461	C	S	.	.			trans	-79.7	115.1	174.7	-171.5	0	0	0	0	112.4	Y433 C434 G435 K436 F438 L444 H447 H451	C431-Y433 PolarHBondContact O-N 3.2Å; C431-Y433 VanDerWaalsContact O-N 3.11Å; C431-C434 PolarHBondContact O-N 3.46Å; C431-C434 VanDerWaalsContact O-N 3.15Å; C431-C434 VanDerWaalsContact SG-SG 3.7Å; C431-G435 WeakPolarHBondContact O-CA 3.47Å; C431-G435 PolarHBondContact O-N 2.88Å; C431-K436 HydrophobicContact CB-CB 4.44Å; C431-K436 PolarHBondContact N-O 3.07Å; C431-F438 HydrophobicContact CB-CE2 4.15Å; C431-L444 VanDerWaalsContact CA-CD1 3.49Å; C431-L444 HydrophobicContact CB-CD1 3.56Å; C431-H447 PolarHBondContact SG-CD2 2.86Å; C431-H447 PolarHBondContact SG-NE2 3.36Å; C431-H447 VanDerWaalsContact SG-NE2 3.36Å; C431-H451 VanDerWaalsContact SG-CD2 3.6Å; C431-H451 PolarHBondContact SG-NE2 3.2Å; C431-H451 VanDerWaalsContact SG-NE2 3.44Å
432	E	85.7	Confident	70.6	Confident	113 Å²	113	93 Å²	93	53%	0.528	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-16	-177.6	-53.1	-173.4	147.1	0	0	114.4	R398 I430	R398-E432 IonicContact CZ-OE1 3.85Å; R398-E432 IonicContact NH2-OE1 3.69Å; R398-E432 PolarHBondContact NH2-OE1 2.92Å; R398-E432 IonicContact NH2-OE2 2.66Å; R398-E432 PolarHBondContact NH2-OE2 3.12Å; I430-E432 PolarHBondContact O-N 3.36Å
433	Y	80.8	Confident	73.4	Confident	112 Å²	112	92.8 Å²	92.8	44%	0.439	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-20.1	177.9	-56.6	-73.1	0	0	0	114	C431 H451	C431-Y433 PolarHBondContact O-N 3.2Å; C431-Y433 VanDerWaalsContact O-N 3.11Å; Y433-H451 HydrophobicContact CD2-CB 3.65Å; Y433-H451 AromaticContact CD2-CD2 3.65Å; Y433-H451 AromaticContact CD2-CG 3.7Å; Y433-H451 HydrophobicContact CE2-CB 4.08Å; Y433-H451 HydrophobicContact CG-CB 3.9Å; Y433-H451 AromaticContact CG-CG 3.8Å
434	C	86.9	Confident	75.9	Confident	24 Å²	24	90.3 Å²	90.3	16%	0.162	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	10.7	-172.6	72.1	0	0	0	0	116	C431 K436 H447 H451	C431-C434 PolarHBondContact O-N 3.46Å; C431-C434 VanDerWaalsContact O-N 3.15Å; C431-C434 VanDerWaalsContact SG-SG 3.7Å; C434-K436 PolarHBondContact O-N 2.76Å; C434-H447 PolarHBondContact SG-NE2 3.22Å; C434-H451 PolarHBondContact SG-NE2 3.01Å; C434-H451 VanDerWaalsContact SG-NE2 3.44Å
435	G	84.6	Confident	78.4	Confident	35 Å²	35	89.7 Å²	89.7	36%	0.361	44%	0.439	S	S	.	.			trans	64.6	-0.7	178.4	0	0	0	0	0	116	C431 I437	C431-G435 WeakPolarHBondContact O-CA 3.47Å; C431-G435 PolarHBondContact O-N 2.88Å; G435-I437 PolarHBondContact O-N 3.45Å
436	K	81.2	Confident	80.7	Confident	126 Å²	126	86.2 Å²	86.2	55%	0.548	43%	0.426	S	S	.	.			trans	-64.4	127.6	-177.8	-73.3	-179.5	-176.3	177.3	0	110.7	C431 C434 F438	C431-K436 HydrophobicContact CB-CB 4.44Å; C431-K436 PolarHBondContact N-O 3.07Å; C434-K436 PolarHBondContact O-N 2.76Å; K436-F438 HydrophobicContact CB-CE2 3.64Å; K436-F438 HydrophobicContact CB-CZ 3.92Å; K436-F438 VanDerWaalsContact O-CD2 3.31Å; K436-F438 WeakPolarHBondContact O-CD2 3.46Å; K436-F438 VanDerWaalsContact O-CE2 3.27Å; K436-F438 WeakPolarHBondContact O-CE2 3.37Å
437	I	82.3	Confident	82.8	Confident	98 Å²	98	80.1 Å²	80.1	50%	0.503	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.7	-176.9	-51	-178.3	0	0	0	109.6	R428 I430 G435	R428-I437 HydrophobicContact CB-CG2 3.66Å; R428-I437 HydrophobicContact CG-CG2 4.28Å; I430-I437 HydrophobicContact CG1-CG1 4.25Å; I430-I437 HydrophobicContact CG1-CG2 4.48Å; G435-I437 PolarHBondContact O-N 3.45Å
438	F	85.1	Confident	84.6	Confident	43 Å²	43	75.9 Å²	75.9	19%	0.189	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	154.5	177.6	-63	-88.1	0	0	0	110.7	R428 D429 C431 K436 N443 L444 H447	R428-F438 CarbonylContact C-O 3.33Å; R428-F438 WeakPolarHBondContact CA-O 3.34Å; D429-F438 HydrophobicContact CB-CB 4.46Å; D429-F438 PolarHBondContact N-O 3.34Å; D429-F438 VanDerWaalsContact N-O 3.12Å; D429-F438 PolarHBondContact O-N 2.8Å; C431-F438 HydrophobicContact CB-CE2 4.15Å; K436-F438 HydrophobicContact CB-CE2 3.64Å; K436-F438 HydrophobicContact CB-CZ 3.92Å; K436-F438 VanDerWaalsContact O-CD2 3.31Å; K436-F438 WeakPolarHBondContact O-CD2 3.46Å; K436-F438 VanDerWaalsContact O-CE2 3.27Å; K436-F438 WeakPolarHBondContact O-CE2 3.37Å; F438-N443 HydrophobicContact CB-CB 4.27Å; F438-N443 HydrophobicContact CD1-CB 3.89Å; F438-N443 HydrophobicContact CG-CB 4.4Å; F438-L444 HydrophobicContact CB-CB 4.24Å; F438-L444 HydrophobicContact CD2-CB 4.01Å; F438-L444 HydrophobicContact CD2-CD1 3.84Å; F438-L444 HydrophobicContact CE2-CD1 4.07Å; F438-L444 HydrophobicContact CG-CB 4.22Å; F438-H447 HydrophobicContact CE1-CB 3.82Å; F438-H447 HydrophobicContact CE2-CB 3.93Å; F438-H447 AromaticContact CE2-CD2 3.32Å; F438-H447 WeakPolarHBondContact CE2-CD2 3.3Å; F438-H447 AromaticContact CE2-CG 3.63Å; F438-H447 HydrophobicContact CZ-CB 3.43Å; F438-H447 VanDerWaalsContact CZ-CB 3.43Å; F438-H447 AromaticContact CZ-CD2 3.36Å; F438-H447 WeakPolarHBondContact CZ-CD2 3.45Å; F438-H447 AromaticContact CZ-CG 3.17Å; F438-H447 AromaticContact CZ-ND1 3.78Å
439	R	82	Confident	85.6	Confident	214 Å²	214	73 Å²	73	81%	0.808	37%	0.367	S	S	*	.	S	Bend	trans	-82.4	-13.4	178.1	-65.5	-177.7	179.8	-179.8	-1.5	113.7
440	N	81.1	Confident	86	Confident	90 Å²	90	76.4 Å²	76.4	48%	0.481	38%	0.383	S	S	.	.	S	Bend	trans	-155.4	142.1	-171.7	-54.1	85.6	0	0	0	109.9	D429 S442 N443 L444	D429-N440 WeakPolarHBondContact OD2-CA 3.41Å; N440-S442 VanDerWaalsContact C-N 3.3Å; N440-S442 PolarHBondContact O-N 3.45Å; N440-N443 WeakPolarHBondContact O-CB 3.32Å; N440-N443 PolarHBondContact O-N 2.98Å; N440-L444 PolarHBondContact O-N 3.25Å
441	C	86.7	Confident	86.2	Confident	73 Å²	73	74.1 Å²	74.1	49%	0.493	37%	0.371	S	S	.	.	H	α-helix	trans	-59.7	-37.5	-177.6	59.1	0	0	0	0	112.7	D429 N443 L444 T445	D429-C441 VanDerWaalsContact CG-CA 3.4Å; D429-C441 WeakPolarHBondContact OD1-CA 3.17Å; D429-C441 VanDerWaalsContact OD1-CB 3.32Å; D429-C441 WeakPolarHBondContact OD1-CB 3.39Å; D429-C441 WeakPolarHBondContact OD2-CA 3.06Å; D429-C441 PolarHBondContact OD2-N 3.09Å; C441-N443 VanDerWaalsContact C-N 3.25Å; C441-N443 PolarHBondContact O-N 3.4Å; C441-L444 CarbonylContact O-C 3.52Å; C441-L444 WeakPolarHBondContact O-CA 3.24Å; C441-L444 WeakPolarHBondContact O-CB 3.37Å; C441-L444 PolarHBondContact O-N 2.99Å; C441-T445 PolarHBondContact O-N 2.79Å; C441-T445 PolarHBondContact O-OG1 3.22Å
442	S	87.4	Confident	86.1	Confident	80 Å²	80	76.9 Å²	76.9	56%	0.559	39%	0.387	S	S	*	.	H	α-helix	trans	-57.7	-37.5	175.7	-42.7	0	0	0	0	112.6	N440 V446	N440-S442 VanDerWaalsContact C-N 3.3Å; N440-S442 PolarHBondContact O-N 3.45Å; S442-V446 WeakPolarHBondContact O-CB 3.3Å; S442-V446 VanDerWaalsContact O-CG2 3.25Å; S442-V446 WeakPolarHBondContact O-CG2 3.13Å; S442-V446 PolarHBondContact O-N 3.1Å; S442-V446 VanDerWaalsContact O-N 3.08Å
443	N	88.4	Confident	86.2	Confident	88 Å²	88	73.9 Å²	73.9	47%	0.471	39%	0.387	S	S	.	.	H	α-helix	trans	-73.4	-36.3	176.7	-71.4	-32.9	0	0	0	111.5	F438 N440 C441 H447	F438-N443 HydrophobicContact CB-CB 4.27Å; F438-N443 HydrophobicContact CD1-CB 3.89Å; F438-N443 HydrophobicContact CG-CB 4.4Å; N440-N443 WeakPolarHBondContact O-CB 3.32Å; N440-N443 PolarHBondContact O-N 2.98Å; C441-N443 VanDerWaalsContact C-N 3.25Å; C441-N443 PolarHBondContact O-N 3.4Å; N443-H447 VanDerWaalsContact O-CB 3.24Å; N443-H447 WeakPolarHBondContact O-CB 3.47Å; N443-H447 PolarHBondContact O-N 3.32Å
444	L	88.5	Confident	86.4	Confident	23 Å²	23	73.2 Å²	73.2	12%	0.12	39%	0.387	C	S	.	.	H	α-helix	trans	-64.1	-50	171.4	172.3	60.7	0	0	0	111.2	D429 I430 C431 F438 N440 C441 V446 H447 R448	D429-L444 HydrophobicContact CB-CB 3.7Å; D429-L444 HydrophobicContact CB-CD2 3.66Å; D429-L444 HydrophobicContact CB-CG 4.28Å; I430-L444 WeakPolarHBondContact O-CD2 3.41Å; C431-L444 VanDerWaalsContact CA-CD1 3.49Å; C431-L444 HydrophobicContact CB-CD1 3.56Å; F438-L444 HydrophobicContact CB-CB 4.24Å; F438-L444 HydrophobicContact CD2-CB 4.01Å; F438-L444 HydrophobicContact CD2-CD1 3.84Å; F438-L444 HydrophobicContact CE2-CD1 4.07Å; F438-L444 HydrophobicContact CG-CB 4.22Å; N440-L444 PolarHBondContact O-N 3.25Å; C441-L444 CarbonylContact O-C 3.52Å; C441-L444 WeakPolarHBondContact O-CA 3.24Å; C441-L444 WeakPolarHBondContact O-CB 3.37Å; C441-L444 PolarHBondContact O-N 2.99Å; L444-V446 VanDerWaalsContact C-N 3.31Å; L444-V446 PolarHBondContact O-N 3.21Å; L444-H447 CarbonylContact O-C 3.6Å; L444-H447 WeakPolarHBondContact O-CA 3.44Å; L444-H447 WeakPolarHBondContact O-CB 3.31Å; L444-H447 PolarHBondContact O-N 3.23Å; L444-R448 HydrophobicContact CD1-CG 3.93Å; L444-R448 HydrophobicContact CG-CG 4.23Å; L444-R448 WeakPolarHBondContact O-CG 3.35Å; L444-R448 PolarHBondContact O-N 3.34Å
445	T	88.8	Confident	86.6	Confident	70 Å²	70	77.4 Å²	77.4	43%	0.429	40%	0.403	S	S	.	.	H	α-helix	trans	-57.1	-45.1	-179.8	-63.9	0	0	0	0	111.4	C441 H447 R448 R449	C441-T445 PolarHBondContact O-N 2.79Å; C441-T445 PolarHBondContact O-OG1 3.22Å; T445-H447 VanDerWaalsContact C-N 3.32Å; T445-H447 PolarHBondContact O-N 2.88Å; T445-R448 PolarHBondContact O-N 3.37Å; T445-R449 PolarHBondContact O-N 3.3Å
446	V	89.3	Confident	86.9	Confident	38 Å²	38	78.7 Å²	78.7	23%	0.23	41%	0.405	C	S	.	.	H	α-helix	trans	-66.6	-33.1	175	168.6	0	0	0	0	112.2	S442 L444 Q468	S442-V446 WeakPolarHBondContact O-CB 3.3Å; S442-V446 VanDerWaalsContact O-CG2 3.25Å; S442-V446 WeakPolarHBondContact O-CG2 3.13Å; S442-V446 PolarHBondContact O-N 3.1Å; S442-V446 VanDerWaalsContact O-N 3.08Å; L444-V446 VanDerWaalsContact C-N 3.31Å; L444-V446 PolarHBondContact O-N 3.21Å; V446-Q468 HydrophobicContact CG1-CG 3.37Å
447	H	89.7	Confident	87.4	Confident	17 Å²	17	76.8 Å²	76.8	8%	0.079	40%	0.395	C	S	.	.	H	α-helix	trans	-70.8	-36.8	172.7	171.4	63	0	0	0	113	C431 C434 F438 N443 L444 T445 R449 I450 H451	C431-H447 PolarHBondContact SG-CD2 2.86Å; C431-H447 PolarHBondContact SG-NE2 3.36Å; C431-H447 VanDerWaalsContact SG-NE2 3.36Å; C434-H447 PolarHBondContact SG-NE2 3.22Å; F438-H447 HydrophobicContact CE1-CB 3.82Å; F438-H447 HydrophobicContact CE2-CB 3.93Å; F438-H447 AromaticContact CE2-CD2 3.32Å; F438-H447 WeakPolarHBondContact CE2-CD2 3.3Å; F438-H447 AromaticContact CE2-CG 3.63Å; F438-H447 HydrophobicContact CZ-CB 3.43Å; F438-H447 VanDerWaalsContact CZ-CB 3.43Å; F438-H447 AromaticContact CZ-CD2 3.36Å; F438-H447 WeakPolarHBondContact CZ-CD2 3.45Å; F438-H447 AromaticContact CZ-CG 3.17Å; F438-H447 AromaticContact CZ-ND1 3.78Å; N443-H447 VanDerWaalsContact O-CB 3.24Å; N443-H447 WeakPolarHBondContact O-CB 3.47Å; N443-H447 PolarHBondContact O-N 3.32Å; L444-H447 CarbonylContact O-C 3.6Å; L444-H447 WeakPolarHBondContact O-CA 3.44Å; L444-H447 WeakPolarHBondContact O-CB 3.31Å; L444-H447 PolarHBondContact O-N 3.23Å; T445-H447 VanDerWaalsContact C-N 3.32Å; T445-H447 PolarHBondContact O-N 2.88Å; H447-R449 PolarHBondContact O-N 3.15Å; H447-I450 VanDerWaalsContact O-CB 3.27Å; H447-I450 WeakPolarHBondContact O-CB 3.48Å; H447-I450 WeakPolarHBondContact O-CG1 3.26Å; H447-I450 PolarHBondContact O-N 3.43Å; H447-H451 AromaticContact CE1-NE2 3.53Å; H447-H451 AromaticContact NE2-CD2 3.78Å; H447-H451 AromaticContact NE2-NE2 3.1Å; H447-H451 PolarHBondContact NE2-NE2 3.1Å
448	R	88.4	Confident	87.8	Confident	99 Å²	99	78 Å²	78	37%	0.374	40%	0.398	S	S	.	.	H	α-helix	trans	-57.8	-31.8	177.5	-75.9	180	66.5	-136.1	-5.2	112.2	L444 T445 I450 H451 T452	L444-R448 HydrophobicContact CD1-CG 3.93Å; L444-R448 HydrophobicContact CG-CG 4.23Å; L444-R448 WeakPolarHBondContact O-CG 3.35Å; L444-R448 PolarHBondContact O-N 3.34Å; T445-R448 PolarHBondContact O-N 3.37Å; R448-I450 PolarHBondContact O-N 3.39Å; R448-I450 VanDerWaalsContact O-N 3.14Å; R448-H451 WeakPolarHBondContact O-CA 3.12Å; R448-H451 WeakPolarHBondContact O-CB 3.34Å; R448-H451 PolarHBondContact O-N 3.13Å; R448-T452 PolarHBondContact O-N 3.3Å
449	R	90	Very high	88.1	Confident	50 Å²	50	76.6 Å²	76.6	19%	0.189	39%	0.393	C	S	.	.	H	α-helix	trans	-59.5	-19.9	172.9	-63.5	-176.8	175.9	166	0.2	114.7	T445 H447 H451 G453 E454 A467	T445-R449 PolarHBondContact O-N 3.3Å; H447-R449 PolarHBondContact O-N 3.15Å; R449-H451 VanDerWaalsContact C-N 3.32Å; R449-G453 CarbonylContact O-C 3.59Å; R449-G453 WeakPolarHBondContact O-CA 3.47Å; R449-G453 PolarHBondContact O-N 3.49Å; R449-E454 HydrophobicContact CB-CB 4.22Å; R449-E454 HydrophobicContact CG-CB 4.03Å; R449-E454 IonicContact NE-OE2 2.66Å; R449-E454 PolarHBondContact O-N 2.81Å; R449-A467 HydrophobicContact CB-CB 3.8Å; R449-A467 PolarHBondContact NH1-O 2.74Å
450	I	88.8	Confident	88.5	Confident	117 Å²	117	73 Å²	73	60%	0.6	39%	0.39	S	S	*	.	H	α-helix	trans	-72.1	-30.4	172.6	-56.9	179.7	0	0	0	110.8	H447 R448	H447-I450 VanDerWaalsContact O-CB 3.27Å; H447-I450 WeakPolarHBondContact O-CB 3.48Å; H447-I450 WeakPolarHBondContact O-CG1 3.26Å; H447-I450 PolarHBondContact O-N 3.43Å; R448-I450 PolarHBondContact O-N 3.39Å; R448-I450 VanDerWaalsContact O-N 3.14Å
451	H	87.6	Confident	88.9	Confident	46 Å²	46	72.7 Å²	72.7	21%	0.213	39%	0.388	C	S	.	.	H	α-helix	trans	-87.3	-39.2	177.5	-59	-71.4	0	0	0	112.2	C431 Y433 C434 H447 R448 R449 G453	C431-H451 VanDerWaalsContact SG-CD2 3.6Å; C431-H451 PolarHBondContact SG-NE2 3.2Å; C431-H451 VanDerWaalsContact SG-NE2 3.44Å; Y433-H451 HydrophobicContact CD2-CB 3.65Å; Y433-H451 AromaticContact CD2-CD2 3.65Å; Y433-H451 AromaticContact CD2-CG 3.7Å; Y433-H451 HydrophobicContact CE2-CB 4.08Å; Y433-H451 HydrophobicContact CG-CB 3.9Å; Y433-H451 AromaticContact CG-CG 3.8Å; C434-H451 PolarHBondContact SG-NE2 3.01Å; C434-H451 VanDerWaalsContact SG-NE2 3.44Å; H447-H451 AromaticContact CE1-NE2 3.53Å; H447-H451 AromaticContact NE2-CD2 3.78Å; H447-H451 AromaticContact NE2-NE2 3.1Å; H447-H451 PolarHBondContact NE2-NE2 3.1Å; R448-H451 WeakPolarHBondContact O-CA 3.12Å; R448-H451 WeakPolarHBondContact O-CB 3.34Å; R448-H451 PolarHBondContact O-N 3.13Å; R449-H451 VanDerWaalsContact C-N 3.32Å; H451-G453 VanDerWaalsContact C-N 3.31Å
452	T	85.3	Confident	89.1	Confident	58 Å²	58	71.7 Å²	71.7	36%	0.356	38%	0.381	S	S	.	.	H	α-helix	trans	-79.6	-12.3	176.9	65.5	0	0	0	0	113.6	R448 E454	R448-T452 PolarHBondContact O-N 3.3Å; T452-E454 WeakPolarHBondContact CB-OE1 3.4Å; T452-E454 PolarHBondContact O-N 2.93Å; T452-E454 VanDerWaalsContact OG1-CD 3.22Å; T452-E454 WeakPolarHBondContact OG1-CG 3.31Å; T452-E454 PolarHBondContact OG1-OE1 3.37Å
453	G	86.6	Confident	89.2	Confident	50 Å²	50	74.9 Å²	74.9	52%	0.515	40%	0.397	S	S	.	.			trans	73.6	0.4	-176.9	0	0	0	0	0	114.8	R449 H451 K455	R449-G453 CarbonylContact O-C 3.59Å; R449-G453 WeakPolarHBondContact O-CA 3.47Å; R449-G453 PolarHBondContact O-N 3.49Å; H451-G453 VanDerWaalsContact C-N 3.31Å; G453-K455 PolarHBondContact O-N 3.05Å
454	E	86.4	Confident	89.2	Confident	98 Å²	98	75.1 Å²	75.1	46%	0.458	39%	0.392	S	S	.	.			trans	-58	128.7	-178.1	-79.2	165.6	-130.9	0	0	113.3	R449 T452 A467	R449-E454 HydrophobicContact CB-CB 4.22Å; R449-E454 HydrophobicContact CG-CB 4.03Å; R449-E454 IonicContact NE-OE2 2.66Å; R449-E454 PolarHBondContact O-N 2.81Å; T452-E454 WeakPolarHBondContact CB-OE1 3.4Å; T452-E454 PolarHBondContact O-N 2.93Å; T452-E454 VanDerWaalsContact OG1-CD 3.22Å; T452-E454 WeakPolarHBondContact OG1-CG 3.31Å; T452-E454 PolarHBondContact OG1-OE1 3.37Å; E454-A467 WeakPolarHBondContact O-CB 3.38Å
455	K	90.2	Very high	89.2	Confident	113 Å²	113	75.4 Å²	75.4	49%	0.491	40%	0.396	S	S	.	.			trans	-128.3	72.3	177.1	-68.3	172.4	179.8	-178.1	0	111.6	G453 Y457 H458 S465 C466	G453-K455 PolarHBondContact O-N 3.05Å; K455-Y457 PolarHBondContact O-N 3.31Å; K455-H458 PolarHBondContact O-CE1 3.46Å; K455-S465 VanDerWaalsContact CD-OG 3.31Å; K455-S465 WeakPolarHBondContact CD-OG 3.33Å; K455-C466 CarbonylContact C-O 3.47Å; K455-C466 WeakPolarHBondContact CA-O 3.47Å
456	P	90.3	Very high	89.3	Confident	61 Å²	61	72.4 Å²	72.4	40%	0.396	38%	0.378	S	S	.	.			trans	-66.2	-23.1	-172.3	-23.3	36.4	0	0	0	114.7	H458	P456-H458 PolarHBondContact O-ND1 3.13Å
457	Y	92.2	Very high	89.3	Confident	86 Å²	86	71.7 Å²	71.7	34%	0.337	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	107.7	-174.3	-56.8	-77.6	0	0	0	110.7	K455 S465 C466 A467 S469	K455-Y457 PolarHBondContact O-N 3.31Å; Y457-S465 CarbonylContact O-C 3.59Å; Y457-S465 VanDerWaalsContact O-CA 3.31Å; Y457-S465 WeakPolarHBondContact O-CA 3.15Å; Y457-C466 WeakPolarHBondContact CB-O 3.43Å; Y457-C466 PolarHBondContact N-O 3.26Å; Y457-C466 VanDerWaalsContact N-O 3.1Å; Y457-C466 PolarHBondContact O-N 3.46Å; Y457-A467 WeakPolarHBondContact CE2-O 3.24Å; Y457-S469 VanDerWaalsContact CD2-N 3.29Å
458	H	90.4	Very high	89.3	Confident	124 Å²	124	74.2 Å²	74.2	57%	0.574	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.1	-176.7	-60.4	78.8	0	0	0	110.6	K455 P456 L472	K455-H458 PolarHBondContact O-CE1 3.46Å; P456-H458 PolarHBondContact O-ND1 3.13Å; H458-L472 VanDerWaalsContact O-CD2 3.31Å; H458-L472 WeakPolarHBondContact O-CD2 3.22Å
459	C	91.9	Very high	89.5	Confident	13 Å²	13	72.5 Å²	72.5	9%	0.088	39%	0.391	C	S	.	.			trans	-73.3	141.1	165.3	-173.6	0	0	0	0	109.9	I461 C462 Y464 L472 H475 H479	C459-I461 PolarHBondContact SG-N 3.07Å; C459-C462 WeakPolarHBondContact CB-O 3.46Å; C459-C462 VanDerWaalsContact O-O 3.1Å; C459-Y464 WeakPolarHBondContact CB-O 3.4Å; C459-Y464 PolarHBondContact N-O 2.85Å; C459-L472 HydrophobicContact CB-CD1 3.99Å; C459-H475 WeakPolarHBondContact CB-NE2 3.4Å; C459-H475 PolarHBondContact SG-NE2 3.14Å; C459-H479 VanDerWaalsContact SG-CD2 3.54Å; C459-H479 PolarHBondContact SG-NE2 3.32Å
460	N	90.6	Very high	89.6	Confident	139 Å²	139	73.5 Å²	73.5	74%	0.743	41%	0.405	S	S	*	.	S	Bend	trans	-91.6	-1.2	175.2	64.7	-30.4	0	0	0	113.2	M476	N460-M476 WeakPolarHBondContact OD1-CE 3.45Å
461	I	89.9	Confident	89.8	Confident	84 Å²	84	71.9 Å²	71.9	43%	0.431	39%	0.394	S	S	.	.	S	Bend	trans	-111.8	-25.6	-179.6	-60.7	172.4	0	0	0	111.5	C459 M476 H479	C459-I461 PolarHBondContact SG-N 3.07Å; I461-M476 HydrophobicContact CD1-CE 3.8Å; I461-M476 HydrophobicContact CG1-CE 4.38Å; I461-H479 HydrophobicContact CD1-CB 3.67Å
462	C	90.7	Very high	90	Very high	51 Å²	51	71.1 Å²	71.1	35%	0.345	39%	0.392	S	S	.	.	S	Bend	trans	-146.3	173.7	177	72.4	0	0	0	0	111.8	C459 Y464 H475 H479	C459-C462 WeakPolarHBondContact CB-O 3.46Å; C459-C462 VanDerWaalsContact O-O 3.1Å; C462-Y464 PolarHBondContact O-N 2.81Å; C462-Y464 VanDerWaalsContact O-N 3.09Å; C462-H475 PolarHBondContact SG-CE1 3.47Å; C462-H475 PolarHBondContact SG-NE2 2.92Å; C462-H479 PolarHBondContact SG-NE2 3.04Å
463	T	89.5	Confident	90.3	Very high	147 Å²	147	72.5 Å²	72.5	90%	0.902	40%	0.4	S	S	*	.	S	Bend	trans	-70.7	1.4	-177.6	52.3	0	0	0	0	114.8	S465	T463-S465 PolarHBondContact O-N 2.95Å
464	Y	88.5	Confident	90.6	Very high	94 Å²	94	78 Å²	78	37%	0.369	41%	0.405	S	S	.	.			trans	-66.9	122.3	-177.8	-178.1	-101.5	0	0	0	112.3	C459 C462 C466 H475	C459-Y464 WeakPolarHBondContact CB-O 3.4Å; C459-Y464 PolarHBondContact N-O 2.85Å; C462-Y464 PolarHBondContact O-N 2.81Å; C462-Y464 VanDerWaalsContact O-N 3.09Å; Y464-C466 HydrophobicContact CE1-CB 3.89Å; Y464-H475 HydrophobicContact CD1-CB 4.07Å; Y464-H475 AromaticContact CD1-CD2 3.76Å; Y464-H475 AromaticContact CD1-CE1 3.75Å; Y464-H475 AromaticContact CD1-CG 3.52Å; Y464-H475 AromaticContact CD1-ND1 3.52Å; Y464-H475 AromaticContact CD1-NE2 3.89Å; Y464-H475 HydrophobicContact CE1-CB 3.92Å; Y464-H475 AromaticContact CE1-CG 3.89Å; Y464-H475 AromaticContact CG-CE1 3.69Å; Y464-H475 AromaticContact CG-ND1 3.75Å
465	S	89.1	Confident	90.8	Very high	28 Å²	28	74.6 Å²	74.6	20%	0.196	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.3	171.9	65.2	0	0	0	0	112	K455 Y457 T463	K455-S465 VanDerWaalsContact CD-OG 3.31Å; K455-S465 WeakPolarHBondContact CD-OG 3.33Å; Y457-S465 CarbonylContact O-C 3.59Å; Y457-S465 VanDerWaalsContact O-CA 3.31Å; Y457-S465 WeakPolarHBondContact O-CA 3.15Å; T463-S465 PolarHBondContact O-N 2.95Å
466	C	89.2	Confident	90.8	Very high	8 Å²	8	71.6 Å²	71.6	5%	0.054	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	161	-177.2	67	0	0	0	0	113.9	K455 Y457 Y464 Q468 K471 L472	K455-C466 CarbonylContact C-O 3.47Å; K455-C466 WeakPolarHBondContact CA-O 3.47Å; Y457-C466 WeakPolarHBondContact CB-O 3.43Å; Y457-C466 PolarHBondContact N-O 3.26Å; Y457-C466 VanDerWaalsContact N-O 3.1Å; Y457-C466 PolarHBondContact O-N 3.46Å; Y464-C466 HydrophobicContact CE1-CB 3.89Å; C466-Q468 VanDerWaalsContact C-N 3.34Å; C466-Q468 PolarHBondContact O-N 3.1Å; C466-Q468 PolarHBondContact SG-O 2.77Å; C466-K471 HydrophobicContact CB-CB 4.25Å; C466-L472 PolarHBondContact SG-N 3.34Å
467	A	90.3	Very high	90.8	Very high	23 Å²	23	75 Å²	75	19%	0.19	39%	0.386	C	S	.	.	S	Bend	trans	-78.9	-10.4	-177.3	0	0	0	0	0	114.9	R449 E454 Y457	R449-A467 HydrophobicContact CB-CB 3.8Å; R449-A467 PolarHBondContact NH1-O 2.74Å; E454-A467 WeakPolarHBondContact O-CB 3.38Å; Y457-A467 WeakPolarHBondContact CE2-O 3.24Å
468	Q	90.6	Very high	90.6	Very high	70 Å²	70	75.3 Å²	75.3	33%	0.327	39%	0.392	S	S	.	.			trans	-135.1	129.1	-171.1	-76.2	-179.9	-13.2	0	0	112.5	V446 C466 S470 K471 L472	V446-Q468 HydrophobicContact CG1-CG 3.37Å; C466-Q468 VanDerWaalsContact C-N 3.34Å; C466-Q468 PolarHBondContact O-N 3.1Å; C466-Q468 PolarHBondContact SG-O 2.77Å; Q468-S470 VanDerWaalsContact C-N 3.31Å; Q468-S470 PolarHBondContact O-N 2.91Å; Q468-K471 HydrophobicContact CB-CB 4.29Å; Q468-K471 HydrophobicContact CB-CG 3.74Å; Q468-K471 WeakPolarHBondContact O-CB 3.37Å; Q468-K471 PolarHBondContact O-N 3.12Å; Q468-L472 PolarHBondContact O-N 3.22Å
469	S	92.1	Very high	90.3	Very high	62 Å²	62	70.3 Å²	70.3	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-55.9	-41.6	177	51.6	0	0	0	0	112.9	Y457 K471 L472 T473	Y457-S469 VanDerWaalsContact CD2-N 3.29Å; S469-K471 PolarHBondContact O-N 3.16Å; S469-L472 CarbonylContact O-C 3.59Å; S469-L472 WeakPolarHBondContact O-CA 3.33Å; S469-L472 WeakPolarHBondContact O-CB 3.19Å; S469-L472 PolarHBondContact O-N 3.2Å; S469-L472 VanDerWaalsContact O-N 3.08Å; S469-T473 PolarHBondContact O-N 3.1Å; S469-T473 PolarHBondContact O-OG1 3.45Å; S469-T473 VanDerWaalsContact O-OG1 3.05Å
470	S	92.6	Very high	89.5	Confident	71 Å²	71	72.7 Å²	72.7	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-28	178.1	61.8	0	0	0	0	113.8	Q468 R474	Q468-S470 VanDerWaalsContact C-N 3.31Å; Q468-S470 PolarHBondContact O-N 2.91Å; S470-R474 WeakPolarHBondContact O-CB 3.33Å; S470-R474 PolarHBondContact O-N 3.25Å; S470-R474 VanDerWaalsContact O-N 3.11Å
471	K	92.3	Very high	88.1	Confident	84 Å²	84	73.4 Å²	73.4	37%	0.365	38%	0.383	S	S	.	.	H	α-helix	trans	-74.1	-41.7	173.7	-59.3	-67.2	-179.2	179.3	0	110.5	C466 Q468 S469 R474 H475	C466-K471 HydrophobicContact CB-CB 4.25Å; Q468-K471 HydrophobicContact CB-CB 4.29Å; Q468-K471 HydrophobicContact CB-CG 3.74Å; Q468-K471 WeakPolarHBondContact O-CB 3.37Å; Q468-K471 PolarHBondContact O-N 3.12Å; S469-K471 PolarHBondContact O-N 3.16Å; K471-R474 PolarHBondContact O-N 3.17Å; K471-H475 WeakPolarHBondContact O-CB 3.48Å; K471-H475 PolarHBondContact O-N 3.5Å
472	L	91.9	Very high	86.4	Confident	30 Å²	30	74.4 Å²	74.4	16%	0.157	39%	0.386	C	S	.	.	H	α-helix	trans	-60.8	-49.3	171.5	179.5	60.9	0	0	0	111.1	H458 C459 C466 Q468 S469 R474 H475 M476	H458-L472 VanDerWaalsContact O-CD2 3.31Å; H458-L472 WeakPolarHBondContact O-CD2 3.22Å; C459-L472 HydrophobicContact CB-CD1 3.99Å; C466-L472 PolarHBondContact SG-N 3.34Å; Q468-L472 PolarHBondContact O-N 3.22Å; S469-L472 CarbonylContact O-C 3.59Å; S469-L472 WeakPolarHBondContact O-CA 3.33Å; S469-L472 WeakPolarHBondContact O-CB 3.19Å; S469-L472 PolarHBondContact O-N 3.2Å; S469-L472 VanDerWaalsContact O-N 3.08Å; L472-R474 VanDerWaalsContact C-N 3.27Å; L472-R474 PolarHBondContact O-N 2.93Å; L472-H475 CarbonylContact O-C 3.58Å; L472-H475 WeakPolarHBondContact O-CA 3.36Å; L472-H475 WeakPolarHBondContact O-CB 3.31Å; L472-H475 PolarHBondContact O-N 3.35Å; L472-M476 HydrophobicContact CD1-CG 4.25Å; L472-M476 HydrophobicContact CD1-SD 4.07Å; L472-M476 HydrophobicContact CG-CG 4.35Å; L472-M476 WeakPolarHBondContact O-CG 3.35Å; L472-M476 PolarHBondContact O-N 3.36Å
473	T	91.9	Very high	84.5	Confident	86 Å²	86	77.7 Å²	77.7	53%	0.528	40%	0.396	S	S	.	.	H	α-helix	trans	-56.3	-41	177.2	-50.6	0	0	0	0	112.1	S469 M476 K477	S469-T473 PolarHBondContact O-N 3.1Å; S469-T473 PolarHBondContact O-OG1 3.45Å; S469-T473 VanDerWaalsContact O-OG1 3.05Å; T473-M476 PolarHBondContact O-N 3.38Å; T473-K477 PolarHBondContact O-N 3.44Å
474	R	91.3	Very high	82	Confident	166 Å²	166	76.8 Å²	76.8	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-67.2	-38.4	174.9	-172.3	178.5	68.7	154	6.8	112.2	S470 K471 L472 K477	S470-R474 WeakPolarHBondContact O-CB 3.33Å; S470-R474 PolarHBondContact O-N 3.25Å; S470-R474 VanDerWaalsContact O-N 3.11Å; K471-R474 PolarHBondContact O-N 3.17Å; L472-R474 VanDerWaalsContact C-N 3.27Å; L472-R474 PolarHBondContact O-N 2.93Å; R474-K477 WeakPolarHBondContact O-CB 3.33Å; R474-K477 PolarHBondContact O-N 3.36Å
475	H	91.8	Very high	79.6	Confident	26 Å²	26	77.4 Å²	77.4	12%	0.12	40%	0.399	C	S	.	.	H	α-helix	trans	-65.1	-41.9	174.9	168.1	88.9	0	0	0	111.9	C459 C462 Y464 K471 L472 K477 I478 H479	C459-H475 WeakPolarHBondContact CB-NE2 3.4Å; C459-H475 PolarHBondContact SG-NE2 3.14Å; C462-H475 PolarHBondContact SG-CE1 3.47Å; C462-H475 PolarHBondContact SG-NE2 2.92Å; Y464-H475 HydrophobicContact CD1-CB 4.07Å; Y464-H475 AromaticContact CD1-CD2 3.76Å; Y464-H475 AromaticContact CD1-CE1 3.75Å; Y464-H475 AromaticContact CD1-CG 3.52Å; Y464-H475 AromaticContact CD1-ND1 3.52Å; Y464-H475 AromaticContact CD1-NE2 3.89Å; Y464-H475 HydrophobicContact CE1-CB 3.92Å; Y464-H475 AromaticContact CE1-CG 3.89Å; Y464-H475 AromaticContact CG-CE1 3.69Å; Y464-H475 AromaticContact CG-ND1 3.75Å; K471-H475 WeakPolarHBondContact O-CB 3.48Å; K471-H475 PolarHBondContact O-N 3.5Å; L472-H475 CarbonylContact O-C 3.58Å; L472-H475 WeakPolarHBondContact O-CA 3.36Å; L472-H475 WeakPolarHBondContact O-CB 3.31Å; L472-H475 PolarHBondContact O-N 3.35Å; H475-K477 PolarHBondContact O-N 3.44Å; H475-K477 VanDerWaalsContact O-N 3.13Å; H475-I478 WeakPolarHBondContact O-CA 3.47Å; H475-I478 WeakPolarHBondContact O-CB 3.26Å; H475-I478 WeakPolarHBondContact O-CG1 3.44Å; H475-I478 PolarHBondContact O-N 2.92Å; H475-H479 AromaticContact CE1-NE2 3.81Å; H475-H479 AromaticContact NE2-CD2 3.74Å; H475-H479 AromaticContact NE2-NE2 3.22Å; H475-H479 PolarHBondContact NE2-NE2 3.41Å
476	M	90.3	Very high	76.9	Confident	50 Å²	50	81.4 Å²	81.4	25%	0.246	43%	0.426	C	S	.	.	H	α-helix	trans	-58.7	-28.9	176.7	-65	-50.2	-69.9	0	0	113	N460 I461 L472 T473 I478 H479 S480	N460-M476 WeakPolarHBondContact OD1-CE 3.45Å; I461-M476 HydrophobicContact CD1-CE 3.8Å; I461-M476 HydrophobicContact CG1-CE 4.38Å; L472-M476 HydrophobicContact CD1-CG 4.25Å; L472-M476 HydrophobicContact CD1-SD 4.07Å; L472-M476 HydrophobicContact CG-CG 4.35Å; L472-M476 WeakPolarHBondContact O-CG 3.35Å; L472-M476 PolarHBondContact O-N 3.36Å; T473-M476 PolarHBondContact O-N 3.38Å; M476-I478 PolarHBondContact O-N 3.24Å; M476-H479 PolarHBondContact O-N 3.1Å; M476-S480 PolarHBondContact O-N 3.08Å; M476-S480 PolarHBondContact O-OG 2.95Å
477	K	90.8	Very high	74.4	Confident	134 Å²	134	89 Å²	89	58%	0.583	46%	0.458	S	S	*	.	H	α-helix	trans	-63	-22.8	172.9	-62.4	-174.6	-179.6	-170.2	0	113.3	T473 R474 H475 K481	T473-K477 PolarHBondContact O-N 3.44Å; R474-K477 WeakPolarHBondContact O-CB 3.33Å; R474-K477 PolarHBondContact O-N 3.36Å; H475-K477 PolarHBondContact O-N 3.44Å; H475-K477 VanDerWaalsContact O-N 3.13Å; K477-K481 WeakPolarHBondContact O-CB 3.44Å; K477-K481 WeakPolarHBondContact O-CG 3.39Å; K477-K481 PolarHBondContact O-N 3.39Å
478	I	87.2	Confident	71.6	Confident	91 Å²	91	95.5 Å²	95.5	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-68.1	-46.9	172.2	-54.4	171.8	0	0	0	108.8	H475 M476 K481 Q482	H475-I478 WeakPolarHBondContact O-CA 3.47Å; H475-I478 WeakPolarHBondContact O-CB 3.26Å; H475-I478 WeakPolarHBondContact O-CG1 3.44Å; H475-I478 PolarHBondContact O-N 2.92Å; M476-I478 PolarHBondContact O-N 3.24Å; I478-K481 PolarHBondContact O-N 3.49Å; I478-Q482 WeakPolarHBondContact O-CG 3.26Å; I478-Q482 PolarHBondContact O-N 3.18Å
479	H	84.8	Confident	68.8	Low	20 Å²	20	101.7 Å²	101.7	9%	0.093	52%	0.515	C	S	.	.	H	α-helix	trans	-65.2	-39.6	175.1	-64.7	-45.8	0	0	0	112.7	C459 I461 C462 H475 M476 K481 Q482 Q483	C459-H479 VanDerWaalsContact SG-CD2 3.54Å; C459-H479 PolarHBondContact SG-NE2 3.32Å; I461-H479 HydrophobicContact CD1-CB 3.67Å; C462-H479 PolarHBondContact SG-NE2 3.04Å; H475-H479 AromaticContact CE1-NE2 3.81Å; H475-H479 AromaticContact NE2-CD2 3.74Å; H475-H479 AromaticContact NE2-NE2 3.22Å; H475-H479 PolarHBondContact NE2-NE2 3.41Å; M476-H479 PolarHBondContact O-N 3.1Å; H479-K481 VanDerWaalsContact C-N 3.3Å; H479-K481 PolarHBondContact O-N 3.47Å; H479-Q482 PolarHBondContact ND1-OE1 3.16Å; H479-Q482 PolarHBondContact O-N 2.77Å; H479-Q483 WeakPolarHBondContact O-CB 3.25Å; H479-Q483 VanDerWaalsContact O-CG 3.3Å; H479-Q483 WeakPolarHBondContact O-CG 3.29Å; H479-Q483 PolarHBondContact O-N 3Å
480	S	73.8	Confident	65.8	Low	63 Å²	63	105.5 Å²	105.5	44%	0.441	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-34.5	173.4	-50.5	0	0	0	0	112.6	M476 N484	M476-S480 PolarHBondContact O-N 3.08Å; M476-S480 PolarHBondContact O-OG 2.95Å; S480-N484 PolarHBondContact O-N 2.82Å
481	K	61.1	Low	62.8	Low	154 Å²	154	106.6 Å²	106.6	67%	0.67	54%	0.543	S	S	*	.	H	α-helix	trans	-68.3	-44.8	171.5	-76.1	-177.9	177.1	-166.8	0	111.2	K477 I478 H479 Q483 N484 T485	K477-K481 WeakPolarHBondContact O-CB 3.44Å; K477-K481 WeakPolarHBondContact O-CG 3.39Å; K477-K481 PolarHBondContact O-N 3.39Å; I478-K481 PolarHBondContact O-N 3.49Å; H479-K481 VanDerWaalsContact C-N 3.3Å; H479-K481 PolarHBondContact O-N 3.47Å; K481-Q483 PolarHBondContact O-N 3.33Å; K481-N484 CarbonylContact O-C 3.58Å; K481-N484 PolarHBondContact O-N 2.89Å; K481-N484 VanDerWaalsContact O-N 3.14Å; K481-T485 WeakPolarHBondContact O-CG2 3.22Å; K481-T485 PolarHBondContact O-N 3.21Å; K481-T485 PolarHBondContact O-OG1 3.34Å
482	Q	55.4	Low	59.9	Low	105 Å²	105	110 Å²	110	49%	0.491	57%	0.565	S	S	.	*	H	α-helix	trans	-63.3	-36.6	176.6	-74.2	173.6	-34.3	0	0	113.2	I478 H479 N484 T485 C486	I478-Q482 WeakPolarHBondContact O-CG 3.26Å; I478-Q482 PolarHBondContact O-N 3.18Å; H479-Q482 PolarHBondContact ND1-OE1 3.16Å; H479-Q482 PolarHBondContact O-N 2.77Å; Q482-N484 VanDerWaalsContact C-N 3.26Å; Q482-N484 PolarHBondContact O-N 3.28Å; Q482-T485 WeakPolarHBondContact CA-OG1 3.26Å; Q482-T485 PolarHBondContact O-N 3.41Å; Q482-T485 PolarHBondContact O-OG1 3.3Å; Q482-C486 WeakPolarHBondContact O-CB 3.49Å; Q482-C486 PolarHBondContact O-N 3.43Å; Q482-C486 VanDerWaalsContact O-N 3.15Å
483	Q	49.6	Very low	57.2	Low	119 Å²	119	113.7 Å²	113.7	56%	0.556	59%	0.594	S	S	*	*	H	α-helix	trans	-67.9	-23.5	174.8	-75.3	175.6	-3.9	0	0	113	H479 K481	H479-Q483 WeakPolarHBondContact O-CB 3.25Å; H479-Q483 VanDerWaalsContact O-CG 3.3Å; H479-Q483 WeakPolarHBondContact O-CG 3.29Å; H479-Q483 PolarHBondContact O-N 3Å; K481-Q483 PolarHBondContact O-N 3.33Å
484	N	37.8	Very low	54.4	Low	128 Å²	128	119 Å²	119	68%	0.684	61%	0.613	S	S	*	*	H	α-helix	trans	-96	-19.8	174.3	-74.4	-16.4	0	0	0	113.8	S480 K481 Q482	S480-N484 PolarHBondContact O-N 2.82Å; K481-N484 CarbonylContact O-C 3.58Å; K481-N484 PolarHBondContact O-N 2.89Å; K481-N484 VanDerWaalsContact O-N 3.14Å; Q482-N484 VanDerWaalsContact C-N 3.26Å; Q482-N484 PolarHBondContact O-N 3.28Å
485	T	37.1	Very low	51.6	Low	108 Å²	108	121 Å²	121	66%	0.663	62%	0.622	S	S	*	*	H	α-helix	trans	-88.4	-9	173.3	56.5	0	0	0	0	113.9	K481 Q482	K481-T485 WeakPolarHBondContact O-CG2 3.22Å; K481-T485 PolarHBondContact O-N 3.21Å; K481-T485 PolarHBondContact O-OG1 3.34Å; Q482-T485 WeakPolarHBondContact CA-OG1 3.26Å; Q482-T485 PolarHBondContact O-N 3.41Å; Q482-T485 PolarHBondContact O-OG1 3.3Å
486	C	33.3	Very low	49	Very low	112 Å²	112	125.2 Å²	125.2	76%	0.757	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	51.5	175.7	-146.1	0	0	0	0	112.8	Q482	Q482-C486 WeakPolarHBondContact O-CB 3.49Å; Q482-C486 PolarHBondContact O-N 3.43Å; Q482-C486 VanDerWaalsContact O-N 3.15Å
487	K	35.9	Very low	46.5	Very low	166 Å²	166	126.9 Å²	126.9	72%	0.722	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	4.6	168.8	-72.2	-171.2	177.7	179.4	0	114.2
488	L	32.1	Very low	44	Very low	160 Å²	160	130.4 Å²	130.4	84%	0.838	68%	0.682	S	S	*	*	S	Bend	trans	-134.6	74.6	-179.4	-78	165.9	0	0	0	110.3
489	K	30.9	Very low	41.6	Very low	200 Å²	200	133.3 Å²	133.3	87%	0.87	69%	0.693	S	S	*	*			trans	-177.1	48.8	157.4	-102.5	166.1	-171	-173.1	0	111
490	T	29.8	Very low	39.4	Very low	143 Å²	143	139 Å²	139	88%	0.877	72%	0.724	S	S	*	*			trans	-118.6	56.5	166.4	53.4	0	0	0	0	109.9
491	S	30.2	Very low	37.4	Very low	94 Å²	94	143.3 Å²	143.3	66%	0.657	74%	0.742	S	S	*	*	S	Bend	trans	-138.9	123.6	157.3	48.4	0	0	0	0	106.3
492	N	30.2	Very low	36.1	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	75%	0.749	S	S	*	*	S	Bend	trans	72	73.4	172.3	-47.9	-7.6	0	0	0	116.9
493	S	35.1	Very low	35	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	75%	0.754	S	S	*	*				170.2	137.9	115.7	45.8	0	0	0	0	111.2	Y495	S493-Y495 PolarHBondContact O-N 3.19Å; S493-Y495 VanDerWaalsContact O-N 3.08Å
494	E	34.5	Very low	34.1	Very low	199 Å²	199	148.8 Å²	148.8	93%	0.93	77%	0.771	S	S	*	*			trans	-84.6	27.9	-167.2	-64.8	175.8	106.5	0	0	114.6
495	Y	32.6	Very low	33.9	Very low	207 Å²	207	151.3 Å²	151.3	81%	0.812	78%	0.776	S	S	*	*			trans	-121.8	120.7	-177.1	-83.4	-96.5	0	0	0	111.6	S493	S493-Y495 PolarHBondContact O-N 3.19Å; S493-Y495 VanDerWaalsContact O-N 3.08Å
496	S	36.2	Very low	33.3	Very low	115 Å²	115	154.2 Å²	154.2	80%	0.804	79%	0.787	S	S	*	*	S	Bend	trans	67.7	136.5	-172.1	88.8	0	0	0	0	113.2
497	V	37.9	Very low	33.1	Very low	85 Å²	85	152.3 Å²	152.3	52%	0.515	79%	0.787	S	S	.	*	S	Bend	cis	-135.9	73.9	6.2	-179.9	0	0	0	0	109	L500	V497-L500 HydrophobicContact CG1-CB 3.51Å; V497-L500 HydrophobicContact CG1-CD1 3.59Å; V497-L500 HydrophobicContact CG1-CG 3.67Å
498	K	39.3	Very low	32.8	Very low	208 Å²	208	152 Å²	152	90%	0.904	79%	0.793	S	S	*	*	S	Bend	trans	-81.8	-3.3	162.1	-81	-179.3	178.2	171.3	0	112.7
499	H	36	Very low	32.7	Very low	151 Å²	151	153.7 Å²	153.7	70%	0.699	80%	0.797	S	S	*	*	S	Bend	trans	-99.4	-24.2	-169.4	-135	-41.6	0	0	0	115.9
500	L	37.9	Very low	32.7	Very low	139 Å²	139	149.9 Å²	149.9	73%	0.728	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-7.5	-172.7	-73	172.1	0	0	0	115.5	V497	V497-L500 HydrophobicContact CG1-CB 3.51Å; V497-L500 HydrophobicContact CG1-CD1 3.59Å; V497-L500 HydrophobicContact CG1-CG 3.67Å
501	N	32	Very low	32.8	Very low	155 Å²	155	149 Å²	149	83%	0.829	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	20.7	-173.9	-79.5	-19.9	0	0	0	114.6
502	K	34.8	Very low	33.1	Very low	186 Å²	186	154 Å²	154	81%	0.809	79%	0.793	S	S	*	*			trans	-137.6	-2.5	-175	-111.6	-177.4	179.9	-174.9	0	119	K504	K502-K504 PolarHBondContact O-N 3.31Å
503	T	31	Very low	33.2	Very low	99 Å²	99	152.4 Å²	152.4	61%	0.607	79%	0.794	S	S	*	*			trans	-99.8	72.3	178.2	51.3	0	0	0	0	112.9	F505	T503-F505 PolarHBondContact O-N 3.11Å
504	K	32.6	Very low	33.2	Very low	207 Å²	207	152.1 Å²	152.1	90%	0.9	78%	0.784	S	S	*	*			trans	-72.3	78.1	136.8	-86.7	-172.2	173	-176.1	0	106.9	K502	K502-K504 PolarHBondContact O-N 3.31Å
505	F	32.5	Very low	33.5	Very low	181 Å²	181	147.5 Å²	147.5	79%	0.794	77%	0.77	S	S	*	*			trans	-149.2	126.4	174.3	-106.4	-81.5	0	0	0	110.5	T503	T503-F505 PolarHBondContact O-N 3.11Å
506	N	25.2	Very low	33.9	Very low	169 Å²	169	142.4 Å²	142.4	90%	0.904	76%	0.764	S	S	*	*			trans	-61.2	142.7	165.9	-65.1	-25.4	0	0	0	109.1
507	G	29.1	Very low	34.1	Very low	72 Å²	72	144.3 Å²	144.3	74%	0.742	76%	0.76	S	S	*	*			trans	155.5	122.1	169	0	0	0	0	0	114
508	N	28.5	Very low	34.5	Very low	160 Å²	160	147.2 Å²	147.2	86%	0.856	77%	0.766	S	S	*	*			trans	-59.4	166.4	158.7	-60.1	-38.9	0	0	0	110.2
509	Q	31.5	Very low	34.6	Very low	196 Å²	196	143.3 Å²	143.3	92%	0.916	75%	0.746	S	S	*	*			trans	88.1	81.6	174.5	-49.3	176.4	2.6	0	0	117.2
510	C	29.7	Very low	34.8	Very low	119 Å²	119	142.3 Å²	142.3	80%	0.804	74%	0.742	S	S	*	*			trans	-155.5	157.6	132.6	-158.5	0	0	0	0	110.5
511	N	32.1	Very low	35.1	Very low	125 Å²	125	143 Å²	143	67%	0.668	74%	0.741	S	S	*	*			trans	94.6	45.4	177.4	-54.4	-17.1	0	0	0	117.9
512	K	35.7	Very low	35.4	Very low	199 Å²	199	141.4 Å²	141.4	87%	0.865	73%	0.728	S	S	*	*	S	Bend	trans	-77.1	151.8	130.9	-71.3	178.9	177.4	177.9	0	107.9
513	S	33.3	Very low	35.9	Very low	121 Å²	121	136.9 Å²	136.9	85%	0.846	71%	0.713	S	S	*	*			trans	89.4	19.5	170.7	-45.8	0	0	0	0	120.3
514	L	35.4	Very low	36.3	Very low	101 Å²	101	136.9 Å²	136.9	53%	0.529	71%	0.706	S	S	.	*			trans	-99.9	113.5	154.6	-121.5	74	0	0	0	109.8	Y519	L514-Y519 HydrophobicContact CB-CD2 4.35Å; L514-Y519 HydrophobicContact CD2-CD2 4.08Å
515	T	40.4	Very low	36.7	Very low	103 Å²	103	129.6 Å²	129.6	63%	0.632	68%	0.684	S	S	*	*			trans	-68	138.3	178.9	44.8	0	0	0	0	111.1	H517 K518	T515-H517 PolarHBondContact O-N 3.42Å; T515-K518 PolarHBondContact O-N 3.05Å
516	S	40.5	Very low	37.1	Very low	99 Å²	99	123.5 Å²	123.5	69%	0.692	66%	0.663	S	S	*	*	H	α-helix	trans	-37.5	-48.8	-170.3	-174.4	0	0	0	0	114.7	K518 Y519	S516-K518 VanDerWaalsContact C-N 3.28Å; S516-K518 PolarHBondContact O-N 3.5Å; S516-Y519 WeakPolarHBondContact O-CB 3.11Å; S516-Y519 PolarHBondContact O-N 2.84Å
517	H	41.3	Very low	37.8	Very low	156 Å²	156	121.9 Å²	121.9	72%	0.722	65%	0.648	S	S	*	*	H	α-helix	trans	-63.5	-26.2	-174.1	-156.4	0.3	0	0	0	114.8	T515	T515-H517 PolarHBondContact O-N 3.42Å
518	K	45.3	Very low	38.3	Very low	146 Å²	146	128.1 Å²	128.1	64%	0.635	65%	0.651	S	S	*	*	H	α-helix	trans	-81.8	-16.3	175.2	-77.1	-176.1	175.6	178.9	0	113.2	T515 S516 H522	T515-K518 PolarHBondContact O-N 3.05Å; S516-K518 VanDerWaalsContact C-N 3.28Å; S516-K518 PolarHBondContact O-N 3.5Å; K518-H522 PolarHBondContact O-N 2.72Å
519	Y	41.5	Very low	38.9	Very low	125 Å²	125	126.5 Å²	126.5	49%	0.49	65%	0.646	S	S	.	*	H	α-helix	trans	-77.4	-40.8	-178.5	-142	-94.6	0	0	0	111.6	L514 S516 H522 L523	L514-Y519 HydrophobicContact CB-CD2 4.35Å; L514-Y519 HydrophobicContact CD2-CD2 4.08Å; S516-Y519 WeakPolarHBondContact O-CB 3.11Å; S516-Y519 PolarHBondContact O-N 2.84Å; Y519-H522 PolarHBondContact O-N 3.25Å; Y519-L523 HydrophobicContact CD1-CD1 3.77Å; Y519-L523 HydrophobicContact CD1-CG 4.24Å; Y519-L523 HydrophobicContact CE1-CD1 4.16Å; Y519-L523 HydrophobicContact CE1-CG 4.49Å; Y519-L523 WeakPolarHBondContact O-CG 3.49Å; Y519-L523 PolarHBondContact O-N 3.28Å
520	E	40.4	Very low	39.2	Very low	130 Å²	130	126.9 Å²	126.9	61%	0.607	65%	0.653	S	S	*	*	H	α-helix	trans	-63	-45.6	176.9	-65.2	-175.3	138.8	0	0	112.2	H522 L523 E524	E520-H522 PolarHBondContact O-N 3.31Å; E520-L523 PolarHBondContact O-N 3.46Å; E520-L523 VanDerWaalsContact O-N 3.15Å; E520-E524 PolarHBondContact O-N 2.98Å
521	H	43.9	Very low	39.6	Very low	153 Å²	153	127.3 Å²	127.3	71%	0.708	65%	0.645	S	S	*	*	H	α-helix	trans	-67.3	-22.6	179.1	-148.6	-52.7	0	0	0	112.9	A525	H521-A525 WeakPolarHBondContact O-CB 3.29Å; H521-A525 PolarHBondContact O-N 3Å
522	H	39.7	Very low	40	Very low	123 Å²	123	127.4 Å²	127.4	57%	0.569	64%	0.644	S	S	*	*	H	α-helix	trans	-81.4	-36	173.3	-137.6	-52.6	0	0	0	112.1	K518 Y519 E520 C526	K518-H522 PolarHBondContact O-N 2.72Å; Y519-H522 PolarHBondContact O-N 3.25Å; E520-H522 PolarHBondContact O-N 3.31Å; H522-C526 WeakPolarHBondContact O-CB 3.36Å; H522-C526 PolarHBondContact O-N 3.4Å; H522-C526 PolarHBondContact O-SG 3.21Å
523	L	45.4	Very low	40.3	Very low	91 Å²	91	123.4 Å²	123.4	48%	0.476	63%	0.631	S	S	.	*	H	α-helix	trans	-68.8	-41.7	174.6	-76.2	168.1	0	0	0	111.9	Y519 E520 A525 C526 K527	Y519-L523 HydrophobicContact CD1-CD1 3.77Å; Y519-L523 HydrophobicContact CD1-CG 4.24Å; Y519-L523 HydrophobicContact CE1-CD1 4.16Å; Y519-L523 HydrophobicContact CE1-CG 4.49Å; Y519-L523 WeakPolarHBondContact O-CG 3.49Å; Y519-L523 PolarHBondContact O-N 3.28Å; E520-L523 PolarHBondContact O-N 3.46Å; E520-L523 VanDerWaalsContact O-N 3.15Å; L523-A525 VanDerWaalsContact C-N 3.33Å; L523-A525 PolarHBondContact O-N 3.21Å; L523-C526 PolarHBondContact O-N 2.84Å; L523-K527 WeakPolarHBondContact O-CG 3.15Å; L523-K527 PolarHBondContact O-N 2.72Å
524	E	39	Very low	40.7	Very low	99 Å²	99	123.6 Å²	123.6	46%	0.463	62%	0.619	S	S	.	*	H	α-helix	trans	-67.7	-34.3	177.9	-144.8	62.3	-152.2	0	0	112	E520 K527	E520-E524 PolarHBondContact O-N 2.98Å; E524-K527 VanDerWaalsContact CD-NZ 3.31Å; E524-K527 WeakPolarHBondContact OE1-CD 3.34Å; E524-K527 IonicContact OE1-NZ 3.04Å; E524-K527 PolarHBondContact OE1-NZ 3.25Å; E524-K527 WeakPolarHBondContact OE2-CE 3.43Å; E524-K527 IonicContact OE2-NZ 3.17Å; E524-K527 PolarHBondContact OE2-NZ 3.2Å
525	A	40.6	Very low	41	Very low	54 Å²	54	125 Å²	125	45%	0.446	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-38.1	170.8	0	0	0	0	0	112.5	H521 L523 Y528	H521-A525 WeakPolarHBondContact O-CB 3.29Å; H521-A525 PolarHBondContact O-N 3Å; L523-A525 VanDerWaalsContact C-N 3.33Å; L523-A525 PolarHBondContact O-N 3.21Å; A525-Y528 PolarHBondContact O-N 2.8Å
526	C	40.8	Very low	41.1	Very low	53 Å²	53	126.5 Å²	126.5	36%	0.358	62%	0.624	S	S	.	*	H	α-helix	trans	-72.2	-27.6	177.4	-74.2	0	0	0	0	113.6	H522 L523 Y528 V529 I530	H522-C526 WeakPolarHBondContact O-CB 3.36Å; H522-C526 PolarHBondContact O-N 3.4Å; H522-C526 PolarHBondContact O-SG 3.21Å; L523-C526 PolarHBondContact O-N 2.84Å; C526-Y528 PolarHBondContact O-N 2.8Å; C526-Y528 VanDerWaalsContact O-N 3.15Å; C526-V529 PolarHBondContact O-N 3.02Å; C526-I530 PolarHBondContact O-N 3.24Å
527	K	40.3	Very low	41.1	Very low	134 Å²	134	128.4 Å²	128.4	58%	0.583	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-17.3	172.9	-78.2	175.3	-174.1	166	0	114.2	L523 E524	L523-K527 WeakPolarHBondContact O-CG 3.15Å; L523-K527 PolarHBondContact O-N 2.72Å; E524-K527 VanDerWaalsContact CD-NZ 3.31Å; E524-K527 WeakPolarHBondContact OE1-CD 3.34Å; E524-K527 IonicContact OE1-NZ 3.04Å; E524-K527 PolarHBondContact OE1-NZ 3.25Å; E524-K527 WeakPolarHBondContact OE2-CE 3.43Å; E524-K527 IonicContact OE2-NZ 3.17Å; E524-K527 PolarHBondContact OE2-NZ 3.2Å
528	Y	40.1	Very low	41.1	Very low	204 Å²	204	126.3 Å²	126.3	80%	0.8	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	5.2	174.6	-79	-86.5	0	0	0	113.7	A525 C526	A525-Y528 PolarHBondContact O-N 2.8Å; C526-Y528 PolarHBondContact O-N 2.8Å; C526-Y528 VanDerWaalsContact O-N 3.15Å
529	V	40.7	Very low	40.7	Very low	125 Å²	125	124.7 Å²	124.7	76%	0.758	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.5	-6.2	-174.5	-177.1	0	0	0	0	113.1	C526	C526-V529 PolarHBondContact O-N 3.02Å
530	I	36.8	Very low	40.7	Very low	205 Å²	205	124.6 Å²	124.6	100%	1.051	62%	0.62	S	S	*	*			trans	-102.6	0	169.1	-57.4	176.4	0	0	0	109.2	C526	C526-I530 PolarHBondContact O-N 3.24Å

Retrieved 530 of 530 residues in 330.2 ms (Link to these results)

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